Complex Ketones

Organic compounds that contain one or more ketone functional groups; a ketone functional group consists of a carbonyl with a carbon atom, or other functional group adjacent to each side.

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Acetophenone, 98%, pure

CAS: 98-86-2 MDL Number: MFCD00008724 InChI Key: KWOLFJPFCHCOCG-UHFFFAOYSA-N Synonym: acetophenone,methyl phenyl ketone,acetylbenzene,phenyl methyl ketone,ethanone, 1-phenyl,hypnone,benzoyl methide,acetophenon,1-phenylethan-1-one,acetylbenzol PubChem CID: 7410 ChEBI: CHEBI:27632 IUPAC Name: 1-phenylethanone SMILES: CC(=O)C1=CC=CC=C1

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PubChem CID	7410
CAS	98-86-2
ChEBI	CHEBI:27632
MDL Number	MFCD00008724
SMILES	CC(=O)C1=CC=CC=C1
Synonym	acetophenone,methyl phenyl ketone,acetylbenzene,phenyl methyl ketone,ethanone, 1-phenyl,hypnone,benzoyl methide,acetophenon,1-phenylethan-1-one,acetylbenzol
IUPAC Name	1-phenylethanone
InChI Key	KWOLFJPFCHCOCG-UHFFFAOYSA-N

Benzil, 99+%

CAS: 134-81-6 Molecular Formula: C14H10O2 Molecular Weight (g/mol): 210.23 MDL Number: MFCD00003080 InChI Key: WURBFLDFSFBTLW-UHFFFAOYSA-N Synonym: benzil,diphenylethanedione,dibenzoyl,diphenylglyoxal,bibenzoyl,ethanedione, diphenyl,1,2-diphenylethanedione,diphenylethane-1,2-dione,glyoxal, diphenyl,diphenyldiketon PubChem CID: 8651 ChEBI: CHEBI:51507 IUPAC Name: 1,2-diphenylethane-1,2-dione SMILES: O=C(C(=O)C1=CC=CC=C1)C1=CC=CC=C1

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Specifications

PubChem CID	8651
CAS	134-81-6
Molecular Weight (g/mol)	210.23
ChEBI	CHEBI:51507
MDL Number	MFCD00003080
SMILES	O=C(C(=O)C1=CC=CC=C1)C1=CC=CC=C1
Synonym	benzil,diphenylethanedione,dibenzoyl,diphenylglyoxal,bibenzoyl,ethanedione, diphenyl,1,2-diphenylethanedione,diphenylethane-1,2-dione,glyoxal, diphenyl,diphenyldiketon
IUPAC Name	1,2-diphenylethane-1,2-dione
InChI Key	WURBFLDFSFBTLW-UHFFFAOYSA-N
Molecular Formula	C14H10O2

D-Psicose, 98%

CAS: 551-68-8 Molecular Formula: C₆H₁₂O₆ Molecular Weight (g/mol): 180.16 MDL Number: MFCD00083478 InChI Key: BJHIKXHVCXFQLS-PUFIMZNGSA-N Synonym: erythrohexulose,3r,4r,5r-1,3,4,5,6-pentahydroxyhexan-2-one,pseudofructose,unii-qcc18lng3e,d-ribo-hex-2-ulose,qcc18lng3e,dl-psicose,ribo-2-hexulose,d-ribo-2-ketohexose,keto-d-psicose PubChem CID: 90008 ChEBI: CHEBI:27605 IUPAC Name: (3R,4R,5R)-1,3,4,5,6-pentahydroxyhexan-2-one SMILES: C(C(C(C(C(=O)CO)O)O)O)O

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Specifications

PubChem CID	90008
CAS	551-68-8
Molecular Weight (g/mol)	180.16
ChEBI	CHEBI:27605
MDL Number	MFCD00083478
SMILES	C(C(C(C(C(=O)CO)O)O)O)O
Synonym	erythrohexulose,3r,4r,5r-1,3,4,5,6-pentahydroxyhexan-2-one,pseudofructose,unii-qcc18lng3e,d-ribo-hex-2-ulose,qcc18lng3e,dl-psicose,ribo-2-hexulose,d-ribo-2-ketohexose,keto-d-psicose
IUPAC Name	(3R,4R,5R)-1,3,4,5,6-pentahydroxyhexan-2-one
InChI Key	BJHIKXHVCXFQLS-PUFIMZNGSA-N
Molecular Formula	C₆H₁₂O₆

D(-)-Fructose, specified according the requirements of USP

CAS: 57-48-7 Molecular Formula: C₆H₁₂O₆ Molecular Weight (g/mol): 180.16 InChI Key: BJHIKXHVCXFQLS-UYFOZJQFSA-N Synonym: d---fructose,d--fructose,3s,4r,5r-1,3,4,5,6-pentahydroxyhexan-2-one,furucton,arabino-hexulose,keto-d-fructose,d-levulose,sugar, fruit,fructose, d,krystar 300 PubChem CID: 5984 ChEBI: CHEBI:48095 IUPAC Name: (3S,4R,5R)-1,3,4,5,6-pentahydroxyhexan-2-one SMILES: C(C(C(C(C(=O)CO)O)O)O)O

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Specifications

PubChem CID	5984
CAS	57-48-7
Molecular Weight (g/mol)	180.16
ChEBI	CHEBI:48095
SMILES	C(C(C(C(C(=O)CO)O)O)O)O
Synonym	d---fructose,d--fructose,3s,4r,5r-1,3,4,5,6-pentahydroxyhexan-2-one,furucton,arabino-hexulose,keto-d-fructose,d-levulose,sugar, fruit,fructose, d,krystar 300
IUPAC Name	(3S,4R,5R)-1,3,4,5,6-pentahydroxyhexan-2-one
InChI Key	BJHIKXHVCXFQLS-UYFOZJQFSA-N
Molecular Formula	C₆H₁₂O₆

2,6-Dichloroindophenol, sodium salt hydrate, 90+%

CAS: 1266615-56-8 Molecular Formula: C12H6Cl2NNaO2 Molecular Weight (g/mol): 290.07 MDL Number: MFCD00150014 InChI Key: CVSUAFOWIXUYQA-UHFFFAOYSA-M Synonym: 2,6-dichloroindophenol sodium salt dihydrate,2,6-dichloro-4-4-hydroxyphenyl azamethylene cyclohexa-2,5-dien-1-one, oxamet hane, oxamethane, sodium salt,c12h6cl2no2.na.2h2o,2,6-dichlorophenol-indophenol sodium salt dihydrate,sodium 4-3,5-dichloro-4-oxocyclohexa-2,5-dien-1-ylidene amino phenolate dihydrate,sodium 4-3,5-dichloro-4-oxocyclohexa-2,5-dien-1-ylidene amino benzenolate dihydrate PubChem CID: 23696612 IUPAC Name: sodium;4-[(3,5-dichloro-4-oxocyclohexa-2,5-dien-1-ylidene)amino]phenolate;dihydrate SMILES: [Na+].[O-]C1=CC=C(C=C1)N=C1C=C(Cl)C(=O)C(Cl)=C1

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Specifications

PubChem CID	23696612
CAS	1266615-56-8
Molecular Weight (g/mol)	290.07
MDL Number	MFCD00150014
SMILES	[Na+].[O-]C1=CC=C(C=C1)N=C1C=C(Cl)C(=O)C(Cl)=C1
Synonym	2,6-dichloroindophenol sodium salt dihydrate,2,6-dichloro-4-4-hydroxyphenyl azamethylene cyclohexa-2,5-dien-1-one, oxamet hane, oxamethane, sodium salt,c12h6cl2no2.na.2h2o,2,6-dichlorophenol-indophenol sodium salt dihydrate,sodium 4-3,5-dichloro-4-oxocyclohexa-2,5-dien-1-ylidene amino phenolate dihydrate,sodium 4-3,5-dichloro-4-oxocyclohexa-2,5-dien-1-ylidene amino benzenolate dihydrate
IUPAC Name	sodium;4-[(3,5-dichloro-4-oxocyclohexa-2,5-dien-1-ylidene)amino]phenolate;dihydrate
InChI Key	CVSUAFOWIXUYQA-UHFFFAOYSA-M
Molecular Formula	C12H6Cl2NNaO2

4'-Methoxypropiophenone, 99%

CAS: 121-97-1 Molecular Formula: C₁₀H₁₂O₂ Molecular Weight (g/mol): 164.2 MDL Number: MFCD00009310 InChI Key: ZJVAWPKTWVFKHG-UHFFFAOYSA-N PubChem CID: 67144 IUPAC Name: 1-(4-methoxyphenyl)propan-1-one SMILES: CCC(=O)C1=CC=C(C=C1)OC

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Specifications

PubChem CID	67144
CAS	121-97-1
Molecular Weight (g/mol)	164.2
MDL Number	MFCD00009310
SMILES	CCC(=O)C1=CC=C(C=C1)OC
IUPAC Name	1-(4-methoxyphenyl)propan-1-one
InChI Key	ZJVAWPKTWVFKHG-UHFFFAOYSA-N
Molecular Formula	C₁₀H₁₂O₂

3',5'-Dimethoxy-4'-hydroxyacetophenone, 97%

CAS: 2478-38-8 Molecular Formula: C10H12O4 Molecular Weight (g/mol): 196.20 MDL Number: MFCD00008748 InChI Key: OJOBTAOGJIWAGB-UHFFFAOYSA-N Synonym: acetosyringone,3',5'-dimethoxy-4'-hydroxyacetophenone,1-4-hydroxy-3,5-dimethoxyphenyl ethanone,4'-hydroxy-3',5'-dimethoxyacetophenone,3,5-dimethoxy-4-hydroxyacetophenone,acetosyringon,ethanone, 1-4-hydroxy-3,5-dimethoxyphenyl,1-4-hydroxy-3,5-dimethoxyphenyl ethan-1-one,acetosyringenin,acetophenone, 4'-hydroxy-3',5'-dimethoxy PubChem CID: 17198 ChEBI: CHEBI:2404 IUPAC Name: 1-(4-hydroxy-3,5-dimethoxyphenyl)ethanone SMILES: COC1=CC(=CC(OC)=C1O)C(C)=O

Pricing and Availability
Specifications

PubChem CID	17198
CAS	2478-38-8
Molecular Weight (g/mol)	196.20
ChEBI	CHEBI:2404
MDL Number	MFCD00008748
SMILES	COC1=CC(=CC(OC)=C1O)C(C)=O
Synonym	acetosyringone,3',5'-dimethoxy-4'-hydroxyacetophenone,1-4-hydroxy-3,5-dimethoxyphenyl ethanone,4'-hydroxy-3',5'-dimethoxyacetophenone,3,5-dimethoxy-4-hydroxyacetophenone,acetosyringon,ethanone, 1-4-hydroxy-3,5-dimethoxyphenyl,1-4-hydroxy-3,5-dimethoxyphenyl ethan-1-one,acetosyringenin,acetophenone, 4'-hydroxy-3',5'-dimethoxy
IUPAC Name	1-(4-hydroxy-3,5-dimethoxyphenyl)ethanone
InChI Key	OJOBTAOGJIWAGB-UHFFFAOYSA-N
Molecular Formula	C10H12O4

Thermo Scientific Chemicals D(-)-Fructose, 99%

Pricing and Availability
Specifications

PubChem CID	5984
CAS	57-48-7
Molecular Weight (g/mol)	180.16
ChEBI	CHEBI:48095
SMILES	C(C(C(C(C(=O)CO)O)O)O)O
Synonym	d---fructose,d--fructose,3s,4r,5r-1,3,4,5,6-pentahydroxyhexan-2-one,furucton,arabino-hexulose,keto-d-fructose,d-levulose,sugar, fruit,fructose, d,krystar 300
IUPAC Name	(3S,4R,5R)-1,3,4,5,6-pentahydroxyhexan-2-one
InChI Key	BJHIKXHVCXFQLS-UYFOZJQFSA-N
Molecular Formula	C₆H₁₂O₆

4'-Isobutylacetophenone, 97%

CAS: 38861-78-8 Molecular Formula: C₁₂H₁₆O Molecular Weight (g/mol): 176.26 InChI Key: KEAGRYYGYWZVPC-UHFFFAOYSA-N Synonym: 4'-isobutylacetophenone,4-isobutylacetophenone,p-iso-butylacetophenone,1-4-isobutylphenyl ethanone,p-isobutylacetophenone,ethanone, 1-4-2-methylpropyl phenyl,1-4-2-methylpropyl phenyl ethan-1-one,acetophenone, 4-isobutyl,1-4-2-methylpropyl phenyl ethanone,unii-aml715rd20 PubChem CID: 93214 IUPAC Name: 1-[4-(2-methylpropyl)phenyl]ethanone SMILES: CC(C)CC1=CC=C(C=C1)C(=O)C

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Specifications

PubChem CID	93214
CAS	38861-78-8
Molecular Weight (g/mol)	176.26
SMILES	CC(C)CC1=CC=C(C=C1)C(=O)C
Synonym	4'-isobutylacetophenone,4-isobutylacetophenone,p-iso-butylacetophenone,1-4-isobutylphenyl ethanone,p-isobutylacetophenone,ethanone, 1-4-2-methylpropyl phenyl,1-4-2-methylpropyl phenyl ethan-1-one,acetophenone, 4-isobutyl,1-4-2-methylpropyl phenyl ethanone,unii-aml715rd20
IUPAC Name	1-[4-(2-methylpropyl)phenyl]ethanone
InChI Key	KEAGRYYGYWZVPC-UHFFFAOYSA-N
Molecular Formula	C₁₂H₁₆O

4-Hydroxy-4-methyl-2-pentanone, 99%

CAS: 123-42-2 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 MDL Number: MFCD00004471 InChI Key: SWXVUIWOUIDPGS-UHFFFAOYSA-N Synonym: diacetone alcohol,4-hydroxy-4-methyl-2-pentanone,diacetonalkohol,diketone alcohol,diacetonalcohol,tyranton,acetonyldimethylcarbinol,diacetone-alcool,pyranton a,2-methyl-2-pentanol-4-one PubChem CID: 31256 ChEBI: CHEBI:55381 IUPAC Name: 4-hydroxy-4-methylpentan-2-one SMILES: CC(=O)CC(C)(C)O

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Specifications

PubChem CID	31256
CAS	123-42-2
Molecular Weight (g/mol)	116.16
ChEBI	CHEBI:55381
MDL Number	MFCD00004471
SMILES	CC(=O)CC(C)(C)O
Synonym	diacetone alcohol,4-hydroxy-4-methyl-2-pentanone,diacetonalkohol,diketone alcohol,diacetonalcohol,tyranton,acetonyldimethylcarbinol,diacetone-alcool,pyranton a,2-methyl-2-pentanol-4-one
IUPAC Name	4-hydroxy-4-methylpentan-2-one
InChI Key	SWXVUIWOUIDPGS-UHFFFAOYSA-N
Molecular Formula	C6H12O2

2'-Methoxyacetophenone, 99%

CAS: 579-74-8 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.18 MDL Number: MFCD00008725 InChI Key: DWPLEOPKBWNPQV-UHFFFAOYSA-N Synonym: 2'-methoxyacetophenone,1-2-methoxyphenyl ethanone,o-methoxyacetophenone,ethanone, 1-2-methoxyphenyl,o-acetylanisole,1-2-methoxyphenyl ethan-1-one,o-acetanisole,2-acetylanisole,2-methyoxyacetophenone oxime,ortho-methoxyacetophenone PubChem CID: 68481 IUPAC Name: 1-(2-methoxyphenyl)ethanone SMILES: COC1=CC=CC=C1C(C)=O

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Specifications

PubChem CID	68481
CAS	579-74-8
Molecular Weight (g/mol)	150.18
MDL Number	MFCD00008725
SMILES	COC1=CC=CC=C1C(C)=O
Synonym	2'-methoxyacetophenone,1-2-methoxyphenyl ethanone,o-methoxyacetophenone,ethanone, 1-2-methoxyphenyl,o-acetylanisole,1-2-methoxyphenyl ethan-1-one,o-acetanisole,2-acetylanisole,2-methyoxyacetophenone oxime,ortho-methoxyacetophenone
IUPAC Name	1-(2-methoxyphenyl)ethanone
InChI Key	DWPLEOPKBWNPQV-UHFFFAOYSA-N
Molecular Formula	C9H10O2

Pyruvic acid, 98%, extra pure

CAS: 127-17-3 Molecular Formula: C3H4O3 Molecular Weight (g/mol): 88.06 MDL Number: MFCD00002585 InChI Key: LCTONWCANYUPML-UHFFFAOYSA-N Synonym: pyruvic acid,pyroracemic acid,2-oxopropionic acid,acetylformic acid,alpha-ketopropionic acid,2-ketopropionic acid,2-oxopropanoate,propanoic acid, 2-oxo,2-oxo-propionic acid,2-oxopropansaeure PubChem CID: 1060 ChEBI: CHEBI:32816 IUPAC Name: 2-oxopropanoic acid SMILES: CC(=O)C(O)=O

Pricing and Availability
Specifications

PubChem CID	1060
CAS	127-17-3
Molecular Weight (g/mol)	88.06
ChEBI	CHEBI:32816
MDL Number	MFCD00002585
SMILES	CC(=O)C(O)=O
Synonym	pyruvic acid,pyroracemic acid,2-oxopropionic acid,acetylformic acid,alpha-ketopropionic acid,2-ketopropionic acid,2-oxopropanoate,propanoic acid, 2-oxo,2-oxo-propionic acid,2-oxopropansaeure
IUPAC Name	2-oxopropanoic acid
InChI Key	LCTONWCANYUPML-UHFFFAOYSA-N
Molecular Formula	C3H4O3

2,4-Diacetylphloroglucinol, 97%

CAS: 2161-86-6 Molecular Formula: C10H10O5 Molecular Weight (g/mol): 210.19 MDL Number: MFCD00100483 InChI Key: PIFFQYJYNWXNGE-UHFFFAOYSA-N Synonym: 2,4-diacetylphloroglucinol,1-3-acetyl-2,4,6-trihydroxyphenyl ethan-1-one,diacetylphloroglucinol,phloroglucinol, diacetyl,unii-8xv4yyo3wn,8xv4yyo3wn,1-3-acetyl-2,4,6-trihydroxyphenyl ethanone,1,1'-2,4,6-trihydroxy-1,3-phenylene bisethanone,ethanone,1,1'-2,4,6-trihydroxy-1,3-phenylene bis,1-3-acetyl-2,4,6-trihydroxy-phenyl ethanone PubChem CID: 16547 ChEBI: CHEBI:78688 IUPAC Name: 1-(3-acetyl-2,4,6-trihydroxyphenyl)ethanone SMILES: CC(=O)C1=C(O)C(C(C)=O)=C(O)C=C1O

Pricing and Availability
Specifications

PubChem CID	16547
CAS	2161-86-6
Molecular Weight (g/mol)	210.19
ChEBI	CHEBI:78688
MDL Number	MFCD00100483
SMILES	CC(=O)C1=C(O)C(C(C)=O)=C(O)C=C1O
Synonym	2,4-diacetylphloroglucinol,1-3-acetyl-2,4,6-trihydroxyphenyl ethan-1-one,diacetylphloroglucinol,phloroglucinol, diacetyl,unii-8xv4yyo3wn,8xv4yyo3wn,1-3-acetyl-2,4,6-trihydroxyphenyl ethanone,1,1'-2,4,6-trihydroxy-1,3-phenylene bisethanone,ethanone,1,1'-2,4,6-trihydroxy-1,3-phenylene bis,1-3-acetyl-2,4,6-trihydroxy-phenyl ethanone
IUPAC Name	1-(3-acetyl-2,4,6-trihydroxyphenyl)ethanone
InChI Key	PIFFQYJYNWXNGE-UHFFFAOYSA-N
Molecular Formula	C10H10O5

Thermo Scientific Chemicals D(-)-Tagatose, 99+%

CAS: 87-81-0 Molecular Formula: C6H12O6 Molecular Weight (g/mol): 180.156 MDL Number: MFCD00134449 InChI Key: BJHIKXHVCXFQLS-PQLUHFTBSA-N Synonym: 3s,4s,5r-1,3,4,5,6-pentahydroxyhexan-2-one,lyxo-2-hexulose,tagatose, d,d--tagatose,keto-d-tagatose,tagatose nf,unii-t7a20y888y,d-lyxo-hex-2-ulose,naturlose PubChem CID: 92092 ChEBI: CHEBI:47693 IUPAC Name: (3S,4S,5R)-1,3,4,5,6-pentahydroxyhexan-2-one SMILES: C(C(C(C(C(=O)CO)O)O)O)O

Pricing and Availability
Specifications

PubChem CID	92092
CAS	87-81-0
Molecular Weight (g/mol)	180.156
ChEBI	CHEBI:47693
MDL Number	MFCD00134449
SMILES	C(C(C(C(C(=O)CO)O)O)O)O
Synonym	3s,4s,5r-1,3,4,5,6-pentahydroxyhexan-2-one,lyxo-2-hexulose,tagatose, d,d--tagatose,keto-d-tagatose,tagatose nf,unii-t7a20y888y,d-lyxo-hex-2-ulose,naturlose
IUPAC Name	(3S,4S,5R)-1,3,4,5,6-pentahydroxyhexan-2-one
InChI Key	BJHIKXHVCXFQLS-PQLUHFTBSA-N
Molecular Formula	C6H12O6

2-Bromoacetophenone, 98%

CAS: 70-11-1 Molecular Formula: C₈H₇BrO Molecular Weight (g/mol): 199.05 MDL Number: MFCD00000195 InChI Key: LIGACIXOYTUXAW-UHFFFAOYSA-N Synonym: 2-bromoacetophenone,phenacyl bromide,2-bromo-1-phenylethan-1-one,bromoacetophenone,ethanone, 2-bromo-1-phenyl,bromomethyl phenyl ketone,alpha-bromoacetophenone,stauffer 4644,omega-bromoacetophenone,acetophenone, 2-bromo PubChem CID: 6259 ChEBI: CHEBI:51846 IUPAC Name: 2-bromo-1-phenylethanone SMILES: C1=CC=C(C=C1)C(=O)CBr

Pricing and Availability
Specifications

PubChem CID	6259
CAS	70-11-1
Molecular Weight (g/mol)	199.05
ChEBI	CHEBI:51846
MDL Number	MFCD00000195
SMILES	C1=CC=C(C=C1)C(=O)CBr
Synonym	2-bromoacetophenone,phenacyl bromide,2-bromo-1-phenylethan-1-one,bromoacetophenone,ethanone, 2-bromo-1-phenyl,bromomethyl phenyl ketone,alpha-bromoacetophenone,stauffer 4644,omega-bromoacetophenone,acetophenone, 2-bromo
IUPAC Name	2-bromo-1-phenylethanone
InChI Key	LIGACIXOYTUXAW-UHFFFAOYSA-N
Molecular Formula	C₈H₇BrO

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