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Organic acids and derivatives

Organic compounds with acidic properties, and will commonly have carboxylic acids or similar functional groups in their structure. Derived compounds are also included.
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1

1H-Imidazole-2-carboxylic acid, 97%, Thermo Scientific™

CAS: 16042-25-4 Molecular Formula: C4H4N2O2 Molecular Weight (g/mol): 112.088 InChI Key: KYWMCFOWDYFYLV-UHFFFAOYSA-N Synonym: 2-imidazolecarboxylic acid,imidazole-2-carboxylic acid,unii-o9g6515vc1,1h-imidazolecarboxylic acid,2-imidazolecarboxylicacid,2-imidazocarboxylic acid,1h-imidazole-2-carboxylicacid,imidazolecarboxylic,acmc-1avrt,2-carboxy-1h-imidazole PubChem CID: 574321 IUPAC Name: 1H-imidazole-2-carboxylic acid SMILES: C1=CN=C(N1)C(=O)O

PubChem CID 574321
CAS 16042-25-4
Molecular Weight (g/mol) 112.088
SMILES C1=CN=C(N1)C(=O)O
Synonym 2-imidazolecarboxylic acid,imidazole-2-carboxylic acid,unii-o9g6515vc1,1h-imidazolecarboxylic acid,2-imidazolecarboxylicacid,2-imidazocarboxylic acid,1h-imidazole-2-carboxylicacid,imidazolecarboxylic,acmc-1avrt,2-carboxy-1h-imidazole
IUPAC Name 1H-imidazole-2-carboxylic acid
InChI Key KYWMCFOWDYFYLV-UHFFFAOYSA-N
Molecular Formula C4H4N2O2
2

1-Methyl-5-phenyl-1H-pyrazole-3-carboxylic acid, 97%, Thermo Scientific™

CAS: 10199-53-8 Molecular Formula: C11H10N2O2 Molecular Weight (g/mol): 202.21 MDL Number: MFCD08271933 InChI Key: ZDUDGEACIDDEPL-UHFFFAOYSA-N Synonym: 1-methyl-5-phenyl-1h-pyrazole-3-carboxylic acid,1h-pyrazole-3-carboxylicacid, 1-methyl-5-phenyl,1h-pyrazole-3-carboxylic acid, 1-methyl-5-phenyl,3-carboxy-1-methyl-5-phenyl-1h-pyrazole,1-methyl-5-phenyl pyrazole-3-carboxylic acid,3-carboxy-1-methyl-1h-pyrazol-5-yl benzene,1-methyl-5-phenyl-1h-3-pyrazolecarboxylic acid PubChem CID: 7537619 IUPAC Name: 1-methyl-5-phenylpyrazole-3-carboxylic acid SMILES: CN1N=C(C=C1C1=CC=CC=C1)C(O)=O

PubChem CID 7537619
CAS 10199-53-8
Molecular Weight (g/mol) 202.21
MDL Number MFCD08271933
SMILES CN1N=C(C=C1C1=CC=CC=C1)C(O)=O
Synonym 1-methyl-5-phenyl-1h-pyrazole-3-carboxylic acid,1h-pyrazole-3-carboxylicacid, 1-methyl-5-phenyl,1h-pyrazole-3-carboxylic acid, 1-methyl-5-phenyl,3-carboxy-1-methyl-5-phenyl-1h-pyrazole,1-methyl-5-phenyl pyrazole-3-carboxylic acid,3-carboxy-1-methyl-1h-pyrazol-5-yl benzene,1-methyl-5-phenyl-1h-3-pyrazolecarboxylic acid
IUPAC Name 1-methyl-5-phenylpyrazole-3-carboxylic acid
InChI Key ZDUDGEACIDDEPL-UHFFFAOYSA-N
Molecular Formula C11H10N2O2
3

5-Bromo-2,3-dihydrobenzo[b]furan-7-boronic acid, 97%, Thermo Scientific™

CAS: 690632-72-5 Molecular Formula: C8H8BBrO3 Molecular Weight (g/mol): 242.86 MDL Number: MFCD06200893 InChI Key: BSSWVOKZPQTKGW-UHFFFAOYSA-N Synonym: 5-bromo-2,3-dihydrobenzofuran-7-yl boronic acid,5-bromo-2,3-dihydrobenzo b furan-7-boronic acid,5-bromo-2,3-dihydro-1-benzofuran-7-yl boronic acid,acmc-1b7su,5-bromo-2,3-dihydrobenzofuran-7-yl boronicacid,boronic acid, b-5-bromo-2,3-dihydro-7-benzofuranyl PubChem CID: 2794805 IUPAC Name: (5-bromo-2,3-dihydro-1-benzofuran-7-yl)boronic acid SMILES: OB(O)C1=CC(Br)=CC2=C1OCC2

PubChem CID 2794805
CAS 690632-72-5
Molecular Weight (g/mol) 242.86
MDL Number MFCD06200893
SMILES OB(O)C1=CC(Br)=CC2=C1OCC2
Synonym 5-bromo-2,3-dihydrobenzofuran-7-yl boronic acid,5-bromo-2,3-dihydrobenzo b furan-7-boronic acid,5-bromo-2,3-dihydro-1-benzofuran-7-yl boronic acid,acmc-1b7su,5-bromo-2,3-dihydrobenzofuran-7-yl boronicacid,boronic acid, b-5-bromo-2,3-dihydro-7-benzofuranyl
IUPAC Name (5-bromo-2,3-dihydro-1-benzofuran-7-yl)boronic acid
InChI Key BSSWVOKZPQTKGW-UHFFFAOYSA-N
Molecular Formula C8H8BBrO3
4

1-Benzothiophene-7-carboxylic acid, 97%, Thermo Scientific™

CAS: 10134-98-2 Molecular Formula: C9H6O2S Molecular Weight (g/mol): 178.205 InChI Key: LJPSRTWIAXVPIS-UHFFFAOYSA-N Synonym: benzo b thiophene-7-carboxylic acid,benzo b thiophene-7-carboxylicacid,7-carboxybenzo b thiophene,1-benzo b thiophene-7-carboxylic acid PubChem CID: 14235073 IUPAC Name: 1-benzothiophene-7-carboxylic acid SMILES: C1=CC2=C(C(=C1)C(=O)O)SC=C2

PubChem CID 14235073
CAS 10134-98-2
Molecular Weight (g/mol) 178.205
SMILES C1=CC2=C(C(=C1)C(=O)O)SC=C2
Synonym benzo b thiophene-7-carboxylic acid,benzo b thiophene-7-carboxylicacid,7-carboxybenzo b thiophene,1-benzo b thiophene-7-carboxylic acid
IUPAC Name 1-benzothiophene-7-carboxylic acid
InChI Key LJPSRTWIAXVPIS-UHFFFAOYSA-N
Molecular Formula C9H6O2S
5

6-Quinoxalinecarboxylic acid, 95%, Thermo Scientific™

CAS: 6925-00-4 Molecular Formula: C9H6N2O2 Molecular Weight (g/mol): 174.159 InChI Key: JGQDBVXRYDEWGM-UHFFFAOYSA-N Synonym: 6-quinoxalinecarboxylic acid,chinoxalin-6-carbonsaeure,quinoxaline-6-carboxylicacid,pubchem15419,quinoxaline-6-carboxylic acid PubChem CID: 674813 IUPAC Name: quinoxaline-6-carboxylic acid SMILES: C1=CC2=NC=CN=C2C=C1C(=O)O

PubChem CID 674813
CAS 6925-00-4
Molecular Weight (g/mol) 174.159
SMILES C1=CC2=NC=CN=C2C=C1C(=O)O
Synonym 6-quinoxalinecarboxylic acid,chinoxalin-6-carbonsaeure,quinoxaline-6-carboxylicacid,pubchem15419,quinoxaline-6-carboxylic acid
IUPAC Name quinoxaline-6-carboxylic acid
InChI Key JGQDBVXRYDEWGM-UHFFFAOYSA-N
Molecular Formula C9H6N2O2
6

3-Methylbut-2-enyl formate, Thermo Scientific™

CAS: 68480-28-4 Molecular Formula: C6H10O2 Molecular Weight (g/mol): 114.14 MDL Number: MFCD00036614 InChI Key: ZCROFVOAWLRGFY-UHFFFAOYSA-N Synonym: prenyl formate,2-buten-1-ol, 3-methyl-, formate,unii-77xfk1mol6,2-buten-1-ol, 3-methyl-, 1-formate,3-methylbut-2-en-1-yl formate,77xfk1mol6,formic acid, 3-methyl-2-butenyl ester,prenylformiat,3-methyl but-2-enyl formate,3-methyl-2-butenyl formate # PubChem CID: 110373 SMILES: CC(C)=CCOC=O

PubChem CID 110373
CAS 68480-28-4
Molecular Weight (g/mol) 114.14
MDL Number MFCD00036614
SMILES CC(C)=CCOC=O
Synonym prenyl formate,2-buten-1-ol, 3-methyl-, formate,unii-77xfk1mol6,2-buten-1-ol, 3-methyl-, 1-formate,3-methylbut-2-en-1-yl formate,77xfk1mol6,formic acid, 3-methyl-2-butenyl ester,prenylformiat,3-methyl but-2-enyl formate,3-methyl-2-butenyl formate #
InChI Key ZCROFVOAWLRGFY-UHFFFAOYSA-N
Molecular Formula C6H10O2
7

1-Methyl-1H-pyrazole-3-carboxylic acid, 95%, Thermo Scientific™

CAS: 25016-20-0 Molecular Formula: C5H6N2O2 Molecular Weight (g/mol): 126.12 MDL Number: MFCD00464254 InChI Key: YBFIKNNFQIBIQZ-UHFFFAOYSA-N Synonym: 1-methyl-1h-pyrazole-3-carboxylic acid,1h-pyrazole-3-carboxylic acid, 1-methyl,3-carboxy-1-methyl-1h-pyrazole,zlchem 1152,acmc-209ggi,1-methylpyrazolecarboxylic acid,1-methyl-pyrazole-3-carboxylic acid,pyrazole-3-carboxylic acid, 1-methyl,1h-pyrazole-3-carboxylicacid, 1-methyl,1-methyl-1h-4-pyrazole-3-carboxylic acid PubChem CID: 573176 ChEBI: CHEBI:74738 IUPAC Name: 1-methylpyrazole-3-carboxylic acid SMILES: CN1C=CC(=N1)C(O)=O

PubChem CID 573176
CAS 25016-20-0
Molecular Weight (g/mol) 126.12
ChEBI CHEBI:74738
MDL Number MFCD00464254
SMILES CN1C=CC(=N1)C(O)=O
Synonym 1-methyl-1h-pyrazole-3-carboxylic acid,1h-pyrazole-3-carboxylic acid, 1-methyl,3-carboxy-1-methyl-1h-pyrazole,zlchem 1152,acmc-209ggi,1-methylpyrazolecarboxylic acid,1-methyl-pyrazole-3-carboxylic acid,pyrazole-3-carboxylic acid, 1-methyl,1h-pyrazole-3-carboxylicacid, 1-methyl,1-methyl-1h-4-pyrazole-3-carboxylic acid
IUPAC Name 1-methylpyrazole-3-carboxylic acid
InChI Key YBFIKNNFQIBIQZ-UHFFFAOYSA-N
Molecular Formula C5H6N2O2
8

1-(5-Bromo-2,3-dihydro-1H-indol-1-yl)ethan-1-one, 97%, Thermo Scientific™

CAS: 22190-38-1 Molecular Formula: C10H10BrNO Molecular Weight (g/mol): 240.1 MDL Number: MFCD00056017 InChI Key: WQKQAIXOTCPWFE-UHFFFAOYSA-N Synonym: 1-acetyl-5-bromoindoline,1-5-bromoindolin-1-yl ethanone,1-5-bromo-2,3-dihydro-1h-indol-1-yl ethan-1-one,1-5-bromo-2,3-dihydroindol-1-yl ethanone,1-5-bromo-2,3-dihydro-1h-indol-1-yl ethanone,1h-indole, 1-acetyl-5-bromo-2,3-dihydro,1-acetyl-5-bromo-2,3-dihydroindole,acmc-20ailu,5-bromo-n-acetylindoline,maybridge1_005011 PubChem CID: 721847 IUPAC Name: 1-(5-bromo-2,3-dihydroindol-1-yl)ethanone SMILES: CC(=O)N1CCC2=C1C=CC(=C2)Br

PubChem CID 721847
CAS 22190-38-1
Molecular Weight (g/mol) 240.1
MDL Number MFCD00056017
SMILES CC(=O)N1CCC2=C1C=CC(=C2)Br
Synonym 1-acetyl-5-bromoindoline,1-5-bromoindolin-1-yl ethanone,1-5-bromo-2,3-dihydro-1h-indol-1-yl ethan-1-one,1-5-bromo-2,3-dihydroindol-1-yl ethanone,1-5-bromo-2,3-dihydro-1h-indol-1-yl ethanone,1h-indole, 1-acetyl-5-bromo-2,3-dihydro,1-acetyl-5-bromo-2,3-dihydroindole,acmc-20ailu,5-bromo-n-acetylindoline,maybridge1_005011
IUPAC Name 1-(5-bromo-2,3-dihydroindol-1-yl)ethanone
InChI Key WQKQAIXOTCPWFE-UHFFFAOYSA-N
Molecular Formula C10H10BrNO
9

ethyle2-amino-4-(4-methoxyphenyl)-3-thiophenecarboxylate, 97%, Thermo Scientific™

CAS: 15854-11-2 Molecular Formula: C14H15NO3S Molecular Weight (g/mol): 277.338 MDL Number: MFCD01917484 InChI Key: ZUOUKGJUHCKVDK-UHFFFAOYSA-N Synonym: ethyl 2-amino-4-4-methoxyphenyl thiophene-3-carboxylate,ethyl 2-amino-4-4-methoxyphenyl-3-thiophenecarboxylate,2-amino-4-4-methoxyphenyl-thiophene-3-carboxylic acid ethyl ester,2-amino-4-4-methoxyphenyl thiophene-3-carboxylic acid ethyl ester,3-thiophenecarboxylicacid,2-amino-4-4-methoxyphenyl-,ethyl ester,2-amino-4-4-methoxy-phenyl-thiophene-3-carboxylic acid ethyl ester,3-thiophenecarboxylicacid, 2-amino-4-4-methoxyphenyl-, ethyl ester PubChem CID: 727641 IUPAC Name: ethyl 2-amino-4-(4-methoxyphenyl)thiophene-3-carboxylate SMILES: CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)OC)N

PubChem CID 727641
CAS 15854-11-2
Molecular Weight (g/mol) 277.338
MDL Number MFCD01917484
SMILES CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)OC)N
Synonym ethyl 2-amino-4-4-methoxyphenyl thiophene-3-carboxylate,ethyl 2-amino-4-4-methoxyphenyl-3-thiophenecarboxylate,2-amino-4-4-methoxyphenyl-thiophene-3-carboxylic acid ethyl ester,2-amino-4-4-methoxyphenyl thiophene-3-carboxylic acid ethyl ester,3-thiophenecarboxylicacid,2-amino-4-4-methoxyphenyl-,ethyl ester,2-amino-4-4-methoxy-phenyl-thiophene-3-carboxylic acid ethyl ester,3-thiophenecarboxylicacid, 2-amino-4-4-methoxyphenyl-, ethyl ester
IUPAC Name ethyl 2-amino-4-(4-methoxyphenyl)thiophene-3-carboxylate
InChI Key ZUOUKGJUHCKVDK-UHFFFAOYSA-N
Molecular Formula C14H15NO3S
10

ethyle5-amino-1-(4-fluorophenyl)-1H-pyrazole-4-carboxylate, 97%, Thermo Scientific™

CAS: 138907-68-3 Molecular Formula: C12H12FN3O2 Molecular Weight (g/mol): 249.25 MDL Number: MFCD00173917 InChI Key: RPPPCKSHIYWAPW-UHFFFAOYSA-N Synonym: ethyl 5-amino-1-4-fluorophenyl-1h-pyrazole-4-carboxylate,ethyl 5-amino-1-4-fluorophenyl pyrazole-4-carboxylate,ethyl 5-amino-1-4-fluoro-phenyl-1h-pyrazole-4-carboxylate,5-amino-1-4-fluorophenyl-1h-pyrazole-4-carboxylic acid ethyl ester,5-amino-4-ethoxycarbonyl-1-4-fluorophenyl-1h-pyrazole,1-5-amino-4-ethoxycarbonyl-1h-pyrazol-1-yl-4-fluorobenzene,maybridge1_006170,ethyl5-amino-1-4-fluorophenyl-1h-pyrazole-4-carboxylate,ethylaminofluorophenylpyrazolecarboxylate,5-amino-1-4-fluorophenyl-1h-pyrazole-4-carboxyli PubChem CID: 688689 IUPAC Name: ethyl 5-amino-1-(4-fluorophenyl)pyrazole-4-carboxylate SMILES: CCOC(=O)C1=C(N)N(N=C1)C1=CC=C(F)C=C1

PubChem CID 688689
CAS 138907-68-3
Molecular Weight (g/mol) 249.25
MDL Number MFCD00173917
SMILES CCOC(=O)C1=C(N)N(N=C1)C1=CC=C(F)C=C1
Synonym ethyl 5-amino-1-4-fluorophenyl-1h-pyrazole-4-carboxylate,ethyl 5-amino-1-4-fluorophenyl pyrazole-4-carboxylate,ethyl 5-amino-1-4-fluoro-phenyl-1h-pyrazole-4-carboxylate,5-amino-1-4-fluorophenyl-1h-pyrazole-4-carboxylic acid ethyl ester,5-amino-4-ethoxycarbonyl-1-4-fluorophenyl-1h-pyrazole,1-5-amino-4-ethoxycarbonyl-1h-pyrazol-1-yl-4-fluorobenzene,maybridge1_006170,ethyl5-amino-1-4-fluorophenyl-1h-pyrazole-4-carboxylate,ethylaminofluorophenylpyrazolecarboxylate,5-amino-1-4-fluorophenyl-1h-pyrazole-4-carboxyli
IUPAC Name ethyl 5-amino-1-(4-fluorophenyl)pyrazole-4-carboxylate
InChI Key RPPPCKSHIYWAPW-UHFFFAOYSA-N
Molecular Formula C12H12FN3O2
11

Methyl propiolate, 97%, Thermo Scientific™

CAS: 922-67-8 Molecular Formula: C4H4O2 Molecular Weight (g/mol): 84.074 MDL Number: MFCD00008572 InChI Key: IMAKHNTVDGLIRY-UHFFFAOYSA-N Synonym: methyl propiolate,methyl propynoate,2-propynoic acid, methyl ester,propiolic acid, methyl ester,methyl acetylenecarboxylate,methyl ethynecarboxylate,propynoic acid, methyl ester,propynoic acid methyl ester,methyl propargylate,acetylenecarboxylic acid methyl ester PubChem CID: 13536 IUPAC Name: methyl prop-2-ynoate SMILES: COC(=O)C#C

PubChem CID 13536
CAS 922-67-8
Molecular Weight (g/mol) 84.074
MDL Number MFCD00008572
SMILES COC(=O)C#C
Synonym methyl propiolate,methyl propynoate,2-propynoic acid, methyl ester,propiolic acid, methyl ester,methyl acetylenecarboxylate,methyl ethynecarboxylate,propynoic acid, methyl ester,propynoic acid methyl ester,methyl propargylate,acetylenecarboxylic acid methyl ester
IUPAC Name methyl prop-2-ynoate
InChI Key IMAKHNTVDGLIRY-UHFFFAOYSA-N
Molecular Formula C4H4O2
12

1-(tert-butyl)-5-methyl-1H-pyrazole-3-carbohydrazide, Thermo Scientific™

CAS: 306937-23-5 Molecular Formula: C9H16N4O Molecular Weight (g/mol): 196.254 InChI Key: TWKKUKBETOOWRR-UHFFFAOYSA-N Synonym: 1-tert-butyl-5-methyl-1h-pyrazole-3-carbohydrazide,maybridge1_008666,1-tert-butyl-5-methyl-pyrazole-3-carbohydrazide,1-tert-butyl-5-methylpyrazole-3-carbohydrazide,1h-pyrazole-3-carboxylicacid, 1-1,1-dimethylethyl-5-methyl-, hydrazide PubChem CID: 2735685 IUPAC Name: 1-tert-butyl-5-methylpyrazole-3-carbohydrazide SMILES: CC1=CC(=NN1C(C)(C)C)C(=O)NN

PubChem CID 2735685
CAS 306937-23-5
Molecular Weight (g/mol) 196.254
SMILES CC1=CC(=NN1C(C)(C)C)C(=O)NN
Synonym 1-tert-butyl-5-methyl-1h-pyrazole-3-carbohydrazide,maybridge1_008666,1-tert-butyl-5-methyl-pyrazole-3-carbohydrazide,1-tert-butyl-5-methylpyrazole-3-carbohydrazide,1h-pyrazole-3-carboxylicacid, 1-1,1-dimethylethyl-5-methyl-, hydrazide
IUPAC Name 1-tert-butyl-5-methylpyrazole-3-carbohydrazide
InChI Key TWKKUKBETOOWRR-UHFFFAOYSA-N
Molecular Formula C9H16N4O
13

2,3-Dihydro-1-benzofuran-5-ylboronic acid, 95%, May contain varying amounts of anhydride, Thermo Scientific™

CAS: 227305-69-3 Molecular Formula: C8H9BO3 Molecular Weight (g/mol): 163.97 MDL Number: MFCD02681979 InChI Key: ZIXLJHSFAMVHPC-UHFFFAOYSA-N Synonym: 2,3-dihydrobenzofuran-5-boronic acid,2,3-dihydrobenzofuran-5-ylboronic acid,2,3-dihydrobenzofuran-5-yl boronic acid,2,3-dihydrobenzo b furan-5-boronic acid,2,3-dihydrobenzofuran-5-yl-5-boronic acid,boronic acid, 2,3-dihydro-5-benzofuranyl,2,3-dihydro-1-benzofuran-5-yl-boranediol,2,3-dihydro-1-benzofuran-5-yl boronic acid,pubchem7848,zlchem 1108 PubChem CID: 2773380 SMILES: OB(O)C1=CC=C2OCCC2=C1

PubChem CID 2773380
CAS 227305-69-3
Molecular Weight (g/mol) 163.97
MDL Number MFCD02681979
SMILES OB(O)C1=CC=C2OCCC2=C1
Synonym 2,3-dihydrobenzofuran-5-boronic acid,2,3-dihydrobenzofuran-5-ylboronic acid,2,3-dihydrobenzofuran-5-yl boronic acid,2,3-dihydrobenzo b furan-5-boronic acid,2,3-dihydrobenzofuran-5-yl-5-boronic acid,boronic acid, 2,3-dihydro-5-benzofuranyl,2,3-dihydro-1-benzofuran-5-yl-boranediol,2,3-dihydro-1-benzofuran-5-yl boronic acid,pubchem7848,zlchem 1108
InChI Key ZIXLJHSFAMVHPC-UHFFFAOYSA-N
Molecular Formula C8H9BO3
14

N1-[4-(Trifluoromethoxy)phenyl]-2-chloroacetamide, 97%, Thermo Scientific™

CAS: 161290-85-3 Molecular Formula: C9H7ClF3NO2 Molecular Weight (g/mol): 253.61 MDL Number: MFCD00219796 InChI Key: MIWYZHHKNDZBCB-UHFFFAOYSA-N Synonym: 2-chloro-n-4-trifluoromethoxy phenyl acetamide,n-chloroacetyl-4-trifluoromethoxy aniline,n1-4-trifluoromethoxy phenyl-2-chloroacetamide,buttpark 30\07-62,acetamide,2-chloro-n-4-trifluoromethoxy phenyl,2-chloro-4'-trifluoromethoxy acetanilide,pubchem8402,timtec-bb sbb001832 PubChem CID: 601031 IUPAC Name: 2-chloro-N-[4-(trifluoromethoxy)phenyl]acetamide SMILES: FC(F)(F)OC1=CC=C(NC(=O)CCl)C=C1

PubChem CID 601031
CAS 161290-85-3
Molecular Weight (g/mol) 253.61
MDL Number MFCD00219796
SMILES FC(F)(F)OC1=CC=C(NC(=O)CCl)C=C1
Synonym 2-chloro-n-4-trifluoromethoxy phenyl acetamide,n-chloroacetyl-4-trifluoromethoxy aniline,n1-4-trifluoromethoxy phenyl-2-chloroacetamide,buttpark 30\07-62,acetamide,2-chloro-n-4-trifluoromethoxy phenyl,2-chloro-4'-trifluoromethoxy acetanilide,pubchem8402,timtec-bb sbb001832
IUPAC Name 2-chloro-N-[4-(trifluoromethoxy)phenyl]acetamide
InChI Key MIWYZHHKNDZBCB-UHFFFAOYSA-N
Molecular Formula C9H7ClF3NO2
15

Ethyl 5,5-dimethyl-2,4-dioxohexanoate, 97%, Thermo Scientific™

CAS: 13395-36-3 Molecular Formula: C10H16O4 Molecular Weight (g/mol): 200.234 InChI Key: NIMKIMUBJFWPTD-UHFFFAOYSA-N Synonym: ethyl trimethylacetopyruvate,hexanoic acid, 5,5-dimethyl-2,4-dioxo-, ethyl ester,5,5-dimethyl-2,4-dioxo-hexanoic acid ethyl ester,5,5-dimethyl-2,4-dioxohexanoic acid ethyl ester,ethyl pivaloylpyruvate,pivaloylpyruvic acid ethyl ester,3-pivaloylpyruvic acid ethyl ester,ethyl5,5-dimethyl-2,4-dioxohexanoate,trimethylacetopyruvic acid ethyl ester,ethyl 5,5-dimethyl-2,4-dioxo-hexanoate PubChem CID: 83403 IUPAC Name: ethyl 5,5-dimethyl-2,4-dioxohexanoate SMILES: CCOC(=O)C(=O)CC(=O)C(C)(C)C

PubChem CID 83403
CAS 13395-36-3
Molecular Weight (g/mol) 200.234
SMILES CCOC(=O)C(=O)CC(=O)C(C)(C)C
Synonym ethyl trimethylacetopyruvate,hexanoic acid, 5,5-dimethyl-2,4-dioxo-, ethyl ester,5,5-dimethyl-2,4-dioxo-hexanoic acid ethyl ester,5,5-dimethyl-2,4-dioxohexanoic acid ethyl ester,ethyl pivaloylpyruvate,pivaloylpyruvic acid ethyl ester,3-pivaloylpyruvic acid ethyl ester,ethyl5,5-dimethyl-2,4-dioxohexanoate,trimethylacetopyruvic acid ethyl ester,ethyl 5,5-dimethyl-2,4-dioxo-hexanoate
IUPAC Name ethyl 5,5-dimethyl-2,4-dioxohexanoate
InChI Key NIMKIMUBJFWPTD-UHFFFAOYSA-N
Molecular Formula C10H16O4