Benzoic acid esters

Aromatic organic compounds that consist of a benzoic acid in which the hydroxyl group's hydrogen atom is replaced by a methyl group or a different organic functional group; also known as benzoates.

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Methyl 4-aminosalicylate, 97%, Thermo Scientific Chemicals

CAS: 4136-97-4 Molecular Formula: C8H9NO3 Molecular Weight (g/mol): 167.164 MDL Number: MFCD00088091 InChI Key: QQOXBFUTRLDXDP-UHFFFAOYSA-N Synonym: methyl 4-aminosalicylate,methyl p-aminosalicylate,pas methyl ester,p-aminosalicylic acid methyl ester,methyl 4-amino-2-hydroxybenzenecarboxylate,benzoic acid, 4-amino-2-hydroxy-, methyl ester,methyl 4-amino-2-hydroxy-benzoate,salicylic acid, amino-, methyl ester,4-aminosalicylic acid methyl ester,4-amino-2-hydroxy-benzoic acid methyl ester PubChem CID: 77787 ChEBI: CHEBI:35089 IUPAC Name: methyl 4-amino-2-hydroxybenzoate SMILES: COC(=O)C1=C(C=C(C=C1)N)O

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PubChem CID	77787
CAS	4136-97-4
Molecular Weight (g/mol)	167.164
ChEBI	CHEBI:35089
MDL Number	MFCD00088091
SMILES	COC(=O)C1=C(C=C(C=C1)N)O
Synonym	methyl 4-aminosalicylate,methyl p-aminosalicylate,pas methyl ester,p-aminosalicylic acid methyl ester,methyl 4-amino-2-hydroxybenzenecarboxylate,benzoic acid, 4-amino-2-hydroxy-, methyl ester,methyl 4-amino-2-hydroxy-benzoate,salicylic acid, amino-, methyl ester,4-aminosalicylic acid methyl ester,4-amino-2-hydroxy-benzoic acid methyl ester
IUPAC Name	methyl 4-amino-2-hydroxybenzoate
InChI Key	QQOXBFUTRLDXDP-UHFFFAOYSA-N
Molecular Formula	C8H9NO3

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Benzyl salicylate, 99%

CAS: 118-58-1 Molecular Formula: C14H12O3 Molecular Weight (g/mol): 228.247 MDL Number: MFCD00020034 InChI Key: ZCTQGTTXIYCGGC-UHFFFAOYSA-N Synonym: benzyl salicylate,benzyl o-hydroxybenzoate,salicylic acid, benzyl ester,benzoic acid, 2-hydroxy-, phenylmethyl ester,phenylmethyl 2-hydroxybenzoate,salicylic acid benzyl ester,salicyclic acid, benzyl ester,salicylsaeurebenzylester,unii-wao5mnk9tu,salicyclic acid benzyl ester PubChem CID: 8363 IUPAC Name: benzyl 2-hydroxybenzoate SMILES: C1=CC=C(C=C1)COC(=O)C2=CC=CC=C2O

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PubChem CID	8363
CAS	118-58-1
Molecular Weight (g/mol)	228.247
MDL Number	MFCD00020034
SMILES	C1=CC=C(C=C1)COC(=O)C2=CC=CC=C2O
Synonym	benzyl salicylate,benzyl o-hydroxybenzoate,salicylic acid, benzyl ester,benzoic acid, 2-hydroxy-, phenylmethyl ester,phenylmethyl 2-hydroxybenzoate,salicylic acid benzyl ester,salicyclic acid, benzyl ester,salicylsaeurebenzylester,unii-wao5mnk9tu,salicyclic acid benzyl ester
IUPAC Name	benzyl 2-hydroxybenzoate
InChI Key	ZCTQGTTXIYCGGC-UHFFFAOYSA-N
Molecular Formula	C14H12O3

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Propylparaben, NF, BP, EP, 98-102%, Spectrum™ Chemical

CAS: 94-13-3 Molecular Formula: C10H12O3 Molecular Weight (g/mol): 180.20 InChI Key: QELSKZZBTMNZEB-UHFFFAOYSA-N IUPAC Name: propyl 4-hydroxybenzoate SMILES: CCCOC(=O)C1=CC=C(O)C=C1

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CAS	94-13-3
Molecular Weight (g/mol)	180.20
SMILES	CCCOC(=O)C1=CC=C(O)C=C1
IUPAC Name	propyl 4-hydroxybenzoate
InChI Key	QELSKZZBTMNZEB-UHFFFAOYSA-N
Molecular Formula	C10H12O3

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Isobutyl 4-hydroxybenzoate, 98%

CAS: 2-3-4247 Molecular Formula: C11H14O3 Molecular Weight (g/mol): 194.23 MDL Number: MFCD00020167 InChI Key: XPJVKCRENWUEJH-UHFFFAOYSA-N Synonym: isobutyl 4-hydroxybenzoate,isobutylparaben,isobutyl p-hydroxybenzoate,isobutyl paraben,isobutyl-4-hydroxybenzoate,isobutyl parahydroxybenzoate,4-hydroxybenzoic acid isobutyl ester,benzoic acid, 4-hydroxy-, 2-methylpropyl ester,p-oxybenzoesaureisobutylester,unii-0qqj25x58g PubChem CID: 20240 IUPAC Name: 2-methylpropyl 4-hydroxybenzoate SMILES: CC(C)COC(=O)C1=CC=C(C=C1)O

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PubChem CID	20240
CAS	2-3-4247
Molecular Weight (g/mol)	194.23
MDL Number	MFCD00020167
SMILES	CC(C)COC(=O)C1=CC=C(C=C1)O
Synonym	isobutyl 4-hydroxybenzoate,isobutylparaben,isobutyl p-hydroxybenzoate,isobutyl paraben,isobutyl-4-hydroxybenzoate,isobutyl parahydroxybenzoate,4-hydroxybenzoic acid isobutyl ester,benzoic acid, 4-hydroxy-, 2-methylpropyl ester,p-oxybenzoesaureisobutylester,unii-0qqj25x58g
IUPAC Name	2-methylpropyl 4-hydroxybenzoate
InChI Key	XPJVKCRENWUEJH-UHFFFAOYSA-N
Molecular Formula	C11H14O3

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Methylparaben, FCC, 99-100.5%, Spectrum™ Chemical

CAS: 61-68-7 Molecular Formula: C15H15NO2 Molecular Weight (g/mol): 241.29 InChI Key: HYYBABOKPJLUIN-UHFFFAOYSA-N IUPAC Name: 2-[(2,3-dimethylphenyl)amino]benzoic acid SMILES: CC1=CC=CC(NC2=CC=CC=C2C(O)=O)=C1C

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CAS	61-68-7
Molecular Weight (g/mol)	241.29
SMILES	CC1=CC=CC(NC2=CC=CC=C2C(O)=O)=C1C
IUPAC Name	2-[(2,3-dimethylphenyl)amino]benzoic acid
InChI Key	HYYBABOKPJLUIN-UHFFFAOYSA-N
Molecular Formula	C15H15NO2

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Methyl 2-fluoro-4-hydroxybenzoate, 98%

CAS: 197507-22-5 Molecular Formula: C8H7FO3 Molecular Weight (g/mol): 170.139 MDL Number: MFCD09038282 InChI Key: WYSPMXSNCAFCFV-UHFFFAOYSA-N Synonym: 2-fluoro-4-hydroxy-benzoic acid methyl ester,2-fluoro-4-hydroxybenzoic acid methyl ester,benzoic acid, 2-fluoro-4-hydroxy-, methyl ester,methyl-2-fluoro4-hydroxybenzoate,methyl2-fluoro-4-hydroxybenzoate,methyl-2-fluoro-4-hydroxybenzoate,methyl 2-fluoro-4-hydroxy-benzoate,2-fluoro-4-hyroxybenzoic acid methyl ester PubChem CID: 22463192 IUPAC Name: methyl 2-fluoro-4-hydroxybenzoate SMILES: COC(=O)C1=C(C=C(C=C1)O)F

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PubChem CID	22463192
CAS	197507-22-5
Molecular Weight (g/mol)	170.139
MDL Number	MFCD09038282
SMILES	COC(=O)C1=C(C=C(C=C1)O)F
Synonym	2-fluoro-4-hydroxy-benzoic acid methyl ester,2-fluoro-4-hydroxybenzoic acid methyl ester,benzoic acid, 2-fluoro-4-hydroxy-, methyl ester,methyl-2-fluoro4-hydroxybenzoate,methyl2-fluoro-4-hydroxybenzoate,methyl-2-fluoro-4-hydroxybenzoate,methyl 2-fluoro-4-hydroxy-benzoate,2-fluoro-4-hyroxybenzoic acid methyl ester
IUPAC Name	methyl 2-fluoro-4-hydroxybenzoate
InChI Key	WYSPMXSNCAFCFV-UHFFFAOYSA-N
Molecular Formula	C8H7FO3

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Methyl 3,5-dibromo-2-hydroxybenzoate, 98%

CAS: 21702-79-4 Molecular Formula: C8H6Br2O3 Molecular Weight (g/mol): 309.94 MDL Number: MFCD00017534 InChI Key: KISQISIKTRRMOX-UHFFFAOYSA-N PubChem CID: 624217 IUPAC Name: methyl 3,5-dibromo-2-hydroxybenzoate SMILES: COC(=O)C1=CC(Br)=CC(Br)=C1O

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Specifications

PubChem CID	624217
CAS	21702-79-4
Molecular Weight (g/mol)	309.94
MDL Number	MFCD00017534
SMILES	COC(=O)C1=CC(Br)=CC(Br)=C1O
IUPAC Name	methyl 3,5-dibromo-2-hydroxybenzoate
InChI Key	KISQISIKTRRMOX-UHFFFAOYSA-N
Molecular Formula	C8H6Br2O3

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Ethyl 3-hydroxybenzoate, 99%

CAS: 7781-98-8 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.176 MDL Number: MFCD00002296 InChI Key: MWSMNBYIEBRXAL-UHFFFAOYSA-N Synonym: ethyl-3-hydroxybenzoate,benzoic acid, 3-hydroxy-, ethyl ester,3-hydroxybenzoic acid ethyl ester,m-ethoxycarbonylphenol,ethyl m-hydroxybenzoate,3-hydroxy-benzoic acid ethyl ester,benzoic acid, m-hydroxy-, ethyl ester,pubchem19923,acmc-209pbw,ethyl 3-oxidanylbenzoate PubChem CID: 24522 IUPAC Name: ethyl 3-hydroxybenzoate SMILES: CCOC(=O)C1=CC(=CC=C1)O

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PubChem CID	24522
CAS	7781-98-8
Molecular Weight (g/mol)	166.176
MDL Number	MFCD00002296
SMILES	CCOC(=O)C1=CC(=CC=C1)O
Synonym	ethyl-3-hydroxybenzoate,benzoic acid, 3-hydroxy-, ethyl ester,3-hydroxybenzoic acid ethyl ester,m-ethoxycarbonylphenol,ethyl m-hydroxybenzoate,3-hydroxy-benzoic acid ethyl ester,benzoic acid, m-hydroxy-, ethyl ester,pubchem19923,acmc-209pbw,ethyl 3-oxidanylbenzoate
IUPAC Name	ethyl 3-hydroxybenzoate
InChI Key	MWSMNBYIEBRXAL-UHFFFAOYSA-N
Molecular Formula	C9H10O3

Methyl 3-amino-5-hydroxybenzoate, 97%, Thermo Scientific™

CAS: 67973-80-2 Molecular Formula: C8H9NO3 Molecular Weight (g/mol): 167.164 MDL Number: MFCD09263220 InChI Key: DMNGQQIFOZYIRA-UHFFFAOYSA-N Synonym: 3-amino-5-hydroxy-benzoic acid methyl ester,benzoic acid, 3-amino-5-hydroxy-, methyl ester,pubchem17212,acmc-1bgay,dmngqqifozyira-uhfffaoysa,methyl 3-amino-5-hydroxy-benzoate,3-amino-5-methoxycarbonyl phenol,3-hydroxy-5-methoxycarbonyl aniline,3-amino-5-hydroxybenzoic acid methyl ester,5-amino-3-hydroxybenzoic acid methyl ester PubChem CID: 12438277 IUPAC Name: methyl 3-amino-5-hydroxybenzoate SMILES: COC(=O)C1=CC(=CC(=C1)O)N

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Specifications

PubChem CID	12438277
CAS	67973-80-2
Molecular Weight (g/mol)	167.164
MDL Number	MFCD09263220
SMILES	COC(=O)C1=CC(=CC(=C1)O)N
Synonym	3-amino-5-hydroxy-benzoic acid methyl ester,benzoic acid, 3-amino-5-hydroxy-, methyl ester,pubchem17212,acmc-1bgay,dmngqqifozyira-uhfffaoysa,methyl 3-amino-5-hydroxy-benzoate,3-amino-5-methoxycarbonyl phenol,3-hydroxy-5-methoxycarbonyl aniline,3-amino-5-hydroxybenzoic acid methyl ester,5-amino-3-hydroxybenzoic acid methyl ester
IUPAC Name	methyl 3-amino-5-hydroxybenzoate
InChI Key	DMNGQQIFOZYIRA-UHFFFAOYSA-N
Molecular Formula	C8H9NO3

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Methyl 3-aminosalicylate, 97%

CAS: 35748-34-6 Molecular Formula: C8H9NO3 Molecular Weight (g/mol): 167.16 MDL Number: MFCD09842614 InChI Key: OMWQHVRUXLRZRC-UHFFFAOYSA-N Synonym: 3-amino-2-hydroxybenzoic acid methyl ester,benzoic acid, 3-amino-2-hydroxy-, methyl ester,methyl 3-aminosalicylate,methyl3-amino-2-hydroxybenzoate,2-amino-6-methoxycarbonyl phenol,2-hydroxy-3-methoxycarbonyl aniline,methyl-m-aminosalicylat,acmc-209wuz,methyl-3-aminosalicylate,aminohydroxy-benzoic methyl ester PubChem CID: 12782444 IUPAC Name: methyl 3-amino-2-hydroxybenzoate SMILES: COC(=O)C1=C(O)C(N)=CC=C1

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PubChem CID	12782444
CAS	35748-34-6
Molecular Weight (g/mol)	167.16
MDL Number	MFCD09842614
SMILES	COC(=O)C1=C(O)C(N)=CC=C1
Synonym	3-amino-2-hydroxybenzoic acid methyl ester,benzoic acid, 3-amino-2-hydroxy-, methyl ester,methyl 3-aminosalicylate,methyl3-amino-2-hydroxybenzoate,2-amino-6-methoxycarbonyl phenol,2-hydroxy-3-methoxycarbonyl aniline,methyl-m-aminosalicylat,acmc-209wuz,methyl-3-aminosalicylate,aminohydroxy-benzoic methyl ester
IUPAC Name	methyl 3-amino-2-hydroxybenzoate
InChI Key	OMWQHVRUXLRZRC-UHFFFAOYSA-N
Molecular Formula	C8H9NO3

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Benzyl 4-hydroxybenzoate, 99%

CAS: 94-18-8 Molecular Formula: C14H12O3 Molecular Weight (g/mol): 228.25 MDL Number: MFCD00016471 InChI Key: MOZDKDIOPSPTBH-UHFFFAOYSA-N Synonym: benzylparaben,benzyl p-hydroxybenzoate,nipabenzyl,parosept,benzyl paraben,benzyl parasept,benzyl tegosept,solbrol z,benzyl-parasept,p-hydroxybenzoic acid benzyl ester PubChem CID: 7180 ChEBI: CHEBI:34571 IUPAC Name: benzyl 4-hydroxybenzoate SMILES: OC1=CC=C(C=C1)C(=O)OCC1=CC=CC=C1

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PubChem CID	7180
CAS	94-18-8
Molecular Weight (g/mol)	228.25
ChEBI	CHEBI:34571
MDL Number	MFCD00016471
SMILES	OC1=CC=C(C=C1)C(=O)OCC1=CC=CC=C1
Synonym	benzylparaben,benzyl p-hydroxybenzoate,nipabenzyl,parosept,benzyl paraben,benzyl parasept,benzyl tegosept,solbrol z,benzyl-parasept,p-hydroxybenzoic acid benzyl ester
IUPAC Name	benzyl 4-hydroxybenzoate
InChI Key	MOZDKDIOPSPTBH-UHFFFAOYSA-N
Molecular Formula	C14H12O3

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Methyl 3-amino-4-hydroxybenzoate, 95%

CAS: 536-25-4 Molecular Formula: C8H9NO3 Molecular Weight (g/mol): 167.164 MDL Number: MFCD00017095 InChI Key: VNQABZCSYCTZMS-UHFFFAOYSA-N Synonym: orthocaine,orthoform,aminobenz,orthoderm,3-amino-4-hydroxybenzoic acid methyl ester,benzoic acid, 3-amino-4-hydroxy-, methyl ester,methyl m-amino-p-hydroxybenzoate,methyl 4-hydroxy-3-aminobenzoate,methyl 3-amino-4-hydroxybenzenecarboxylate,unii-jk16yi13qk PubChem CID: 10815 ChEBI: CHEBI:34904 IUPAC Name: methyl 3-amino-4-hydroxybenzoate SMILES: COC(=O)C1=CC(=C(C=C1)O)N

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PubChem CID	10815
CAS	536-25-4
Molecular Weight (g/mol)	167.164
ChEBI	CHEBI:34904
MDL Number	MFCD00017095
SMILES	COC(=O)C1=CC(=C(C=C1)O)N
Synonym	orthocaine,orthoform,aminobenz,orthoderm,3-amino-4-hydroxybenzoic acid methyl ester,benzoic acid, 3-amino-4-hydroxy-, methyl ester,methyl m-amino-p-hydroxybenzoate,methyl 4-hydroxy-3-aminobenzoate,methyl 3-amino-4-hydroxybenzenecarboxylate,unii-jk16yi13qk
IUPAC Name	methyl 3-amino-4-hydroxybenzoate
InChI Key	VNQABZCSYCTZMS-UHFFFAOYSA-N
Molecular Formula	C8H9NO3

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Octisalate, USP, 95-105%, Spectrum™ Chemical

CAS: 118-60-5 Molecular Formula: C15H22O3 Molecular Weight (g/mol): 250.34 InChI Key: FMRHJJZUHUTGKE-UHFFFAOYNA-N IUPAC Name: 2-ethylhexyl 2-hydroxybenzoate SMILES: CCCCC(CC)COC(=O)C1=CC=CC=C1O

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CAS	118-60-5
Molecular Weight (g/mol)	250.34
SMILES	CCCCC(CC)COC(=O)C1=CC=CC=C1O
IUPAC Name	2-ethylhexyl 2-hydroxybenzoate
InChI Key	FMRHJJZUHUTGKE-UHFFFAOYNA-N
Molecular Formula	C15H22O3

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Methyl 3,5-dihydroxybenzoate, 97%

CAS: 2150-44-9 Molecular Formula: C8H8O4 Molecular Weight (g/mol): 168.15 MDL Number: MFCD00002289 InChI Key: RNVFYQUEEMZKLR-UHFFFAOYSA-N Synonym: 3,5-dihydroxybenzoic acid methyl ester,benzoic acid, 3,5-dihydroxy-, methyl ester,methyl3,5-dihydroxybenzoate,methyl .alpha.-resorcylate,alpha-resorcinol carboxylic acid methyl ester,alpha-resorcylic acid, methyl ester,.alpha.-resorcylic acid, methyl ester,.alpha.-resorcinol carboxylic acid methyl ester,pubchem21357,methyl alpha-resorcylate PubChem CID: 75076 IUPAC Name: methyl 3,5-dihydroxybenzoate SMILES: COC(=O)C1=CC(O)=CC(O)=C1

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PubChem CID	75076
CAS	2150-44-9
Molecular Weight (g/mol)	168.15
MDL Number	MFCD00002289
SMILES	COC(=O)C1=CC(O)=CC(O)=C1
Synonym	3,5-dihydroxybenzoic acid methyl ester,benzoic acid, 3,5-dihydroxy-, methyl ester,methyl3,5-dihydroxybenzoate,methyl .alpha.-resorcylate,alpha-resorcinol carboxylic acid methyl ester,alpha-resorcylic acid, methyl ester,.alpha.-resorcylic acid, methyl ester,.alpha.-resorcinol carboxylic acid methyl ester,pubchem21357,methyl alpha-resorcylate
IUPAC Name	methyl 3,5-dihydroxybenzoate
InChI Key	RNVFYQUEEMZKLR-UHFFFAOYSA-N
Molecular Formula	C8H8O4

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Ethyl salicylate, 99%

CAS: 118-61-6 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.176 MDL Number: MFCD00002215 InChI Key: GYCKQBWUSACYIF-UHFFFAOYSA-N Synonym: ethyl salicylate,sal ethyl,mesotol,salotan,salicylic ether,salicylic acid, ethyl ester,benzoic acid, 2-hydroxy-, ethyl ester,ethyl o-hydroxybenzoate,o-ethoxycarbonyl phenol,2-hydroxybenzoic acid ethyl ester PubChem CID: 8365 IUPAC Name: ethyl 2-hydroxybenzoate SMILES: CCOC(=O)C1=CC=CC=C1O

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Specifications

PubChem CID	8365
CAS	118-61-6
Molecular Weight (g/mol)	166.176
MDL Number	MFCD00002215
SMILES	CCOC(=O)C1=CC=CC=C1O
Synonym	ethyl salicylate,sal ethyl,mesotol,salotan,salicylic ether,salicylic acid, ethyl ester,benzoic acid, 2-hydroxy-, ethyl ester,ethyl o-hydroxybenzoate,o-ethoxycarbonyl phenol,2-hydroxybenzoic acid ethyl ester
IUPAC Name	ethyl 2-hydroxybenzoate
InChI Key	GYCKQBWUSACYIF-UHFFFAOYSA-N
Molecular Formula	C9H10O3

Benzoic acid esters

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