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Methoxybenzoic acids and derivatives

Organic compounds that consist of benzoic acid with a methoxy group substitution; a methoxy group has an oxygen atom bonded to a methyl group. Includes compounds that are directly derived from methoxybenzoic acid.
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1
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p-Anisic acid, 98%

CAS: 100-09-4 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.15 MDL Number: MFCD00002542 InChI Key: ZEYHEAKUIGZSGI-UHFFFAOYSA-N Synonym: p-anisic acid,anisic acid,p-methoxybenzoic acid,draconic acid,4-anisic acid,benzoic acid, 4-methoxy,anisic acid, para,4-methoxybenzoate,para-anisic acid,anisic acid, p-isomer PubChem CID: 7478 ChEBI: CHEBI:40813 IUPAC Name: 4-methoxybenzoic acid SMILES: COC1=CC=C(C=C1)C(O)=O

EDGE
PubChem CID 7478
CAS 100-09-4
Molecular Weight (g/mol) 152.15
ChEBI CHEBI:40813
MDL Number MFCD00002542
SMILES COC1=CC=C(C=C1)C(O)=O
Synonym p-anisic acid,anisic acid,p-methoxybenzoic acid,draconic acid,4-anisic acid,benzoic acid, 4-methoxy,anisic acid, para,4-methoxybenzoate,para-anisic acid,anisic acid, p-isomer
IUPAC Name 4-methoxybenzoic acid
InChI Key ZEYHEAKUIGZSGI-UHFFFAOYSA-N
Molecular Formula C8H8O3
2

m-Anisic acid, 98%

CAS: 586-38-9 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.15 MDL Number: MFCD00002499 InChI Key: XHQZJYCNDZAGLW-UHFFFAOYSA-N Synonym: m-anisic acid,m-methoxybenzoic acid,benzoic acid, 3-methoxy,3-anisic acid,meta-anisic acid,3-methoxy-benzoic acid,unii-e2i36fh6qz,m-methylsalicylic acid,e2i36fh6qz,chembl22425 PubChem CID: 11461 IUPAC Name: 3-methoxybenzoic acid SMILES: COC1=CC=CC(=C1)C(=O)O

PubChem CID 11461
CAS 586-38-9
Molecular Weight (g/mol) 152.15
MDL Number MFCD00002499
SMILES COC1=CC=CC(=C1)C(=O)O
Synonym m-anisic acid,m-methoxybenzoic acid,benzoic acid, 3-methoxy,3-anisic acid,meta-anisic acid,3-methoxy-benzoic acid,unii-e2i36fh6qz,m-methylsalicylic acid,e2i36fh6qz,chembl22425
IUPAC Name 3-methoxybenzoic acid
InChI Key XHQZJYCNDZAGLW-UHFFFAOYSA-N
Molecular Formula C8H8O3
3
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4-Hydroxy-3-methoxybenzoic acid, 97+%

CAS: 121-34-6 Molecular Formula: C8H8O4 Molecular Weight (g/mol): 168.15 MDL Number: MFCD00002551 InChI Key: WKOLLVMJNQIZCI-UHFFFAOYSA-N Synonym: vanillic acid,acide vanillique,p-vanillic acid,benzoic acid, 4-hydroxy-3-methoxy,3-methoxy-4-hydroxybenzoic acid,vanillate,m-anisic acid, 4-hydroxy,protocatechuic acid, 3-methyl ester,4-hydroxy-3-methoxy-benzoic acid,unii-gm8q3jm2y8 PubChem CID: 8468 ChEBI: CHEBI:30816 IUPAC Name: 4-hydroxy-3-methoxybenzoic acid SMILES: COC1=CC(=CC=C1O)C(O)=O

EDGE
PubChem CID 8468
CAS 121-34-6
Molecular Weight (g/mol) 168.15
ChEBI CHEBI:30816
MDL Number MFCD00002551
SMILES COC1=CC(=CC=C1O)C(O)=O
Synonym vanillic acid,acide vanillique,p-vanillic acid,benzoic acid, 4-hydroxy-3-methoxy,3-methoxy-4-hydroxybenzoic acid,vanillate,m-anisic acid, 4-hydroxy,protocatechuic acid, 3-methyl ester,4-hydroxy-3-methoxy-benzoic acid,unii-gm8q3jm2y8
IUPAC Name 4-hydroxy-3-methoxybenzoic acid
InChI Key WKOLLVMJNQIZCI-UHFFFAOYSA-N
Molecular Formula C8H8O4
4

Ethyl 4-methoxybenzoate, 98+%

CAS: 94-30-4 Molecular Formula: C10H12O3 Molecular Weight (g/mol): 180.203 MDL Number: MFCD00015151 InChI Key: FHUODBDRWMIBQP-UHFFFAOYSA-N Synonym: ethyl p-anisate,ethyl anisate,ethyl p-methoxybenzoate,p-anisic acid, ethyl ester,benzoic acid, 4-methoxy-, ethyl ester,4-methoxybenzoic acid ethyl ester,benzoic acid, p-methoxy-, ethyl ester,ethyl p-anisoate,unii-kj95h2s7nm,p-anisic acid ethyl ester PubChem CID: 60979 IUPAC Name: ethyl 4-methoxybenzoate SMILES: CCOC(=O)C1=CC=C(C=C1)OC

PubChem CID 60979
CAS 94-30-4
Molecular Weight (g/mol) 180.203
MDL Number MFCD00015151
SMILES CCOC(=O)C1=CC=C(C=C1)OC
Synonym ethyl p-anisate,ethyl anisate,ethyl p-methoxybenzoate,p-anisic acid, ethyl ester,benzoic acid, 4-methoxy-, ethyl ester,4-methoxybenzoic acid ethyl ester,benzoic acid, p-methoxy-, ethyl ester,ethyl p-anisoate,unii-kj95h2s7nm,p-anisic acid ethyl ester
IUPAC Name ethyl 4-methoxybenzoate
InChI Key FHUODBDRWMIBQP-UHFFFAOYSA-N
Molecular Formula C10H12O3
5

3-Hydroxy-4-methoxybenzoic acid, 97%

CAS: 645-08-9 Molecular Formula: C8H8O4 Molecular Weight (g/mol): 168.148 MDL Number: MFCD00002507 InChI Key: LBKFGYZQBSGRHY-UHFFFAOYSA-N Synonym: isovanillic acid,acide isovanillique,3-hydroxyanisic acid,3-hydroxy-p-anisic acid,benzoic acid, 3-hydroxy-4-methoxy,p-anisic acid, 3-hydroxy,chembl88700,3-hydroxy-4-methoxy-benzoic acid,3-hydroxy-4-methoxybenzoicacid,5-carboxyguaiacol PubChem CID: 12575 ChEBI: CHEBI:63798 IUPAC Name: 3-hydroxy-4-methoxybenzoic acid SMILES: COC1=C(C=C(C=C1)C(=O)O)O

PubChem CID 12575
CAS 645-08-9
Molecular Weight (g/mol) 168.148
ChEBI CHEBI:63798
MDL Number MFCD00002507
SMILES COC1=C(C=C(C=C1)C(=O)O)O
Synonym isovanillic acid,acide isovanillique,3-hydroxyanisic acid,3-hydroxy-p-anisic acid,benzoic acid, 3-hydroxy-4-methoxy,p-anisic acid, 3-hydroxy,chembl88700,3-hydroxy-4-methoxy-benzoic acid,3-hydroxy-4-methoxybenzoicacid,5-carboxyguaiacol
IUPAC Name 3-hydroxy-4-methoxybenzoic acid
InChI Key LBKFGYZQBSGRHY-UHFFFAOYSA-N
Molecular Formula C8H8O4
6

2,3-Dimethoxybenzoic acid, 99%

CAS: 1521-38-6 Molecular Formula: C9H10O4 Molecular Weight (g/mol): 182.18 MDL Number: MFCD00002432 InChI Key: FODBVCSYJKNBLO-UHFFFAOYSA-N Synonym: o-veratric acid,benzoic acid, 2,3-dimethoxy,benzoic acid, dimethoxy,2,3-dimethoxy benzoic acid,dimethoxybenzoic acid,2,3,o-veratric acid 6ci,7ci,8ci,2,3-dimethoxybenzoicacid,dimethoxybenzoic acid,pubchem4948,2,3-dimethoxy-benzoicaci PubChem CID: 15204 IUPAC Name: 2,3-dimethoxybenzoic acid SMILES: COC1=CC=CC(C(O)=O)=C1OC

PubChem CID 15204
CAS 1521-38-6
Molecular Weight (g/mol) 182.18
MDL Number MFCD00002432
SMILES COC1=CC=CC(C(O)=O)=C1OC
Synonym o-veratric acid,benzoic acid, 2,3-dimethoxy,benzoic acid, dimethoxy,2,3-dimethoxy benzoic acid,dimethoxybenzoic acid,2,3,o-veratric acid 6ci,7ci,8ci,2,3-dimethoxybenzoicacid,dimethoxybenzoic acid,pubchem4948,2,3-dimethoxy-benzoicaci
IUPAC Name 2,3-dimethoxybenzoic acid
InChI Key FODBVCSYJKNBLO-UHFFFAOYSA-N
Molecular Formula C9H10O4
7

Methyl 3,5-dimethoxybenzoate, 98%

CAS: 2150-37-0 Molecular Formula: C10H12O4 Molecular Weight (g/mol): 196.20 MDL Number: MFCD00008432 InChI Key: YXUIOVUOFQKWDM-UHFFFAOYSA-N Synonym: 3,5-dimethoxybenzoic acid methyl ester,benzoic acid, 3,5-dimethoxy-, methyl ester,3,5-dimethoxybenzoic acid methyl,methyl 3,5-bis methyloxy benzoate,acmc-1ccvs,rarechem al bf 0065,methyl 3,5-dimethoxybnezoate,ksc489q8p,ethyl 3,5-dimethoxybenzoate,methyl 3,5-dimethoxybenzoate PubChem CID: 75074 IUPAC Name: methyl 3,5-dimethoxybenzoate SMILES: COC(=O)C1=CC(OC)=CC(OC)=C1

PubChem CID 75074
CAS 2150-37-0
Molecular Weight (g/mol) 196.20
MDL Number MFCD00008432
SMILES COC(=O)C1=CC(OC)=CC(OC)=C1
Synonym 3,5-dimethoxybenzoic acid methyl ester,benzoic acid, 3,5-dimethoxy-, methyl ester,3,5-dimethoxybenzoic acid methyl,methyl 3,5-bis methyloxy benzoate,acmc-1ccvs,rarechem al bf 0065,methyl 3,5-dimethoxybnezoate,ksc489q8p,ethyl 3,5-dimethoxybenzoate,methyl 3,5-dimethoxybenzoate
IUPAC Name methyl 3,5-dimethoxybenzoate
InChI Key YXUIOVUOFQKWDM-UHFFFAOYSA-N
Molecular Formula C10H12O4
8

3,5-Dimethoxybenzoic acid, 98%

CAS: 1132-21-4 Molecular Formula: C9H10O4 Molecular Weight (g/mol): 182.18 MDL Number: MFCD00002502 InChI Key: IWPZKOJSYQZABD-UHFFFAOYSA-N Synonym: benzoic acid, 3,5-dimethoxy,unii-38my78eckk,3,5-dimethoxy benzoic acid,38my78eckk,pubchem3121,3,5-dimethoxybenzoicacid,acmc-1c4zl,3,5-dimethoxy-benzoic acid,ksc176m0p,benzoicacid, 3,5-dimethoxy PubChem CID: 14332 IUPAC Name: 3,5-dimethoxybenzoic acid SMILES: COC1=CC(=CC(OC)=C1)C(O)=O

PubChem CID 14332
CAS 1132-21-4
Molecular Weight (g/mol) 182.18
MDL Number MFCD00002502
SMILES COC1=CC(=CC(OC)=C1)C(O)=O
Synonym benzoic acid, 3,5-dimethoxy,unii-38my78eckk,3,5-dimethoxy benzoic acid,38my78eckk,pubchem3121,3,5-dimethoxybenzoicacid,acmc-1c4zl,3,5-dimethoxy-benzoic acid,ksc176m0p,benzoicacid, 3,5-dimethoxy
IUPAC Name 3,5-dimethoxybenzoic acid
InChI Key IWPZKOJSYQZABD-UHFFFAOYSA-N
Molecular Formula C9H10O4
9

Methyl 2-amino-5-methoxybenzoate, 96%

CAS: 2475-80-1 Molecular Formula: C9H11NO3 Molecular Weight (g/mol): 181.19 MDL Number: MFCD09038482 InChI Key: MOVBJUGHBJJKOW-UHFFFAOYSA-N PubChem CID: 13052275 IUPAC Name: methyl 2-amino-5-methoxybenzoate SMILES: COC(=O)C1=C(N)C=CC(OC)=C1

PubChem CID 13052275
CAS 2475-80-1
Molecular Weight (g/mol) 181.19
MDL Number MFCD09038482
SMILES COC(=O)C1=C(N)C=CC(OC)=C1
IUPAC Name methyl 2-amino-5-methoxybenzoate
InChI Key MOVBJUGHBJJKOW-UHFFFAOYSA-N
Molecular Formula C9H11NO3
10

Methyl 2-amino-3-bromo-5-methoxybenzoate, 96%, Thermo Scientific Chemicals

CAS: 1378874-22-6 Molecular Formula: C9H10BrNO3 Molecular Weight (g/mol): 260.087 MDL Number: MFCD20527215 InChI Key: WPRSGBOUSTUNEC-UHFFFAOYSA-N Synonym: 2-amino-3-bromo-5-methoxybenzoic acid methyl ester PubChem CID: 73995991 IUPAC Name: methyl 2-amino-3-bromo-5-methoxybenzoate SMILES: COC1=CC(=C(C(=C1)C(=O)OC)N)Br

PubChem CID 73995991
CAS 1378874-22-6
Molecular Weight (g/mol) 260.087
MDL Number MFCD20527215
SMILES COC1=CC(=C(C(=C1)C(=O)OC)N)Br
Synonym 2-amino-3-bromo-5-methoxybenzoic acid methyl ester
IUPAC Name methyl 2-amino-3-bromo-5-methoxybenzoate
InChI Key WPRSGBOUSTUNEC-UHFFFAOYSA-N
Molecular Formula C9H10BrNO3
11

2,4,5-Trimethoxybenzoic acid, 99%

CAS: 490-64-2 Molecular Formula: C10H11O5 Molecular Weight (g/mol): 211.19 MDL Number: MFCD00002435 InChI Key: KVZUCOGWKYOPID-UHFFFAOYSA-M Synonym: asaronic acid,benzoic acid, 2,4,5-trimethoxy,asarylic acid,calamonic acid,acmc-209ket,2,4,5-trimethoxybenzoicacid,ksc489o7d,2,4,5-trimethoxy-benzoic acid,2,4,5-trimethoxybenzoic acid,alpha-hydroxyphenylacetic acid; amygdalic acid; alpha-hydroxyphenylacetic acid; alpha-hydroxy-benzeneacetic acid PubChem CID: 10276 SMILES: COC1=CC(OC)=C(C=C1OC)C([O-])=O

PubChem CID 10276
CAS 490-64-2
Molecular Weight (g/mol) 211.19
MDL Number MFCD00002435
SMILES COC1=CC(OC)=C(C=C1OC)C([O-])=O
Synonym asaronic acid,benzoic acid, 2,4,5-trimethoxy,asarylic acid,calamonic acid,acmc-209ket,2,4,5-trimethoxybenzoicacid,ksc489o7d,2,4,5-trimethoxy-benzoic acid,2,4,5-trimethoxybenzoic acid,alpha-hydroxyphenylacetic acid; amygdalic acid; alpha-hydroxyphenylacetic acid; alpha-hydroxy-benzeneacetic acid
InChI Key KVZUCOGWKYOPID-UHFFFAOYSA-M
Molecular Formula C10H11O5
12

2-Amino-4,5-dimethoxybenzoic acid, 98%

CAS: 5653-40-7 Molecular Formula: C9H11NO4 Molecular Weight (g/mol): 197.19 MDL Number: MFCD00011671 InChI Key: HJVAVGOPTDJYOJ-UHFFFAOYSA-N Synonym: 4,5-dimethoxyanthranilic acid,6-aminoveratric acid,benzoic acid, 2-amino-4,5-dimethoxy,2-amino-4,5-dimethoxy benzoic acid,2-amino-4,5-dimethoxy-benzoic acid,6-aminoveratricacid,zlchem 238,pubchem3110,acmc-1b03r,ksc269i1n PubChem CID: 79736 IUPAC Name: 2-amino-4,5-dimethoxybenzoic acid SMILES: COC1=CC(N)=C(C=C1OC)C(O)=O

PubChem CID 79736
CAS 5653-40-7
Molecular Weight (g/mol) 197.19
MDL Number MFCD00011671
SMILES COC1=CC(N)=C(C=C1OC)C(O)=O
Synonym 4,5-dimethoxyanthranilic acid,6-aminoveratric acid,benzoic acid, 2-amino-4,5-dimethoxy,2-amino-4,5-dimethoxy benzoic acid,2-amino-4,5-dimethoxy-benzoic acid,6-aminoveratricacid,zlchem 238,pubchem3110,acmc-1b03r,ksc269i1n
IUPAC Name 2-amino-4,5-dimethoxybenzoic acid
InChI Key HJVAVGOPTDJYOJ-UHFFFAOYSA-N
Molecular Formula C9H11NO4
13

Methyl 3-fluoro-4-methoxybenzoate, 95%, Thermo Scientific™

CAS: 369-30-2 Molecular Formula: C9H9FO3 Molecular Weight (g/mol): 184.17 MDL Number: MFCD00215839 InChI Key: MIKOKYAREMINFF-UHFFFAOYSA-N Synonym: benzoic acid, 3-fluoro-4-methoxy-, methyl ester,methyl 3-fluoro-4-methyloxy benzoate,3-fluoro-4-methoxybenzoic acid methyl ester,pubchem3569,acmc-1ck9v,rarechem al bf 0055,# PubChem CID: 592848 IUPAC Name: methyl 3-fluoro-4-methoxybenzoate SMILES: COC(=O)C1=CC(F)=C(OC)C=C1

PubChem CID 592848
CAS 369-30-2
Molecular Weight (g/mol) 184.17
MDL Number MFCD00215839
SMILES COC(=O)C1=CC(F)=C(OC)C=C1
Synonym benzoic acid, 3-fluoro-4-methoxy-, methyl ester,methyl 3-fluoro-4-methyloxy benzoate,3-fluoro-4-methoxybenzoic acid methyl ester,pubchem3569,acmc-1ck9v,rarechem al bf 0055,#
IUPAC Name methyl 3-fluoro-4-methoxybenzoate
InChI Key MIKOKYAREMINFF-UHFFFAOYSA-N
Molecular Formula C9H9FO3
14

2-Chloro-3-methoxybenzoic acid, 97%

CAS: 33234-36-5 Molecular Formula: C8H7ClO3 Molecular Weight (g/mol): 186.59 MDL Number: MFCD07784399 InChI Key: VIUDWLLKFANPLX-UHFFFAOYSA-N Synonym: benzoic acid, 2-chloro-3-methoxy,acmc-20a6cl,2-chloro-m-anisic acid,2-chloro-3-methoxybenzoicacid,2-chloro-3-methoxybenzoic acid PubChem CID: 16218063 IUPAC Name: 2-chloro-3-methoxybenzoic acid SMILES: COC1=CC=CC(C(O)=O)=C1Cl

PubChem CID 16218063
CAS 33234-36-5
Molecular Weight (g/mol) 186.59
MDL Number MFCD07784399
SMILES COC1=CC=CC(C(O)=O)=C1Cl
Synonym benzoic acid, 2-chloro-3-methoxy,acmc-20a6cl,2-chloro-m-anisic acid,2-chloro-3-methoxybenzoicacid,2-chloro-3-methoxybenzoic acid
IUPAC Name 2-chloro-3-methoxybenzoic acid
InChI Key VIUDWLLKFANPLX-UHFFFAOYSA-N
Molecular Formula C8H7ClO3
15

3-Methoxy-4-methylbenzoic acid, 99%

CAS: 7151-68-0 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.18 MDL Number: MFCD00002566 InChI Key: CEAVPXDEPGAVDA-UHFFFAOYSA-N Synonym: 4-methyl-m-anisic acid,3-methoxy-p-toluic acid,benzoic acid, 3-methoxy-4-methyl,3-methoxy-4-methyl-benzoic acid,3-methoxy-4-methyl benzoic acid,3-methoxy-p-toluic acid; 4-methyl-m-anisic acid,3-methoxy-4-methylbenzoicacid,pubchem2672,5-carboxy-2-methylanisole,acmc-209oj0 PubChem CID: 81579 IUPAC Name: 3-methoxy-4-methylbenzoic acid SMILES: COC1=CC(=CC=C1C)C(O)=O

PubChem CID 81579
CAS 7151-68-0
Molecular Weight (g/mol) 166.18
MDL Number MFCD00002566
SMILES COC1=CC(=CC=C1C)C(O)=O
Synonym 4-methyl-m-anisic acid,3-methoxy-p-toluic acid,benzoic acid, 3-methoxy-4-methyl,3-methoxy-4-methyl-benzoic acid,3-methoxy-4-methyl benzoic acid,3-methoxy-p-toluic acid; 4-methyl-m-anisic acid,3-methoxy-4-methylbenzoicacid,pubchem2672,5-carboxy-2-methylanisole,acmc-209oj0
IUPAC Name 3-methoxy-4-methylbenzoic acid
InChI Key CEAVPXDEPGAVDA-UHFFFAOYSA-N
Molecular Formula C9H10O3