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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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1 – 15 de 114 résultats
1

Methyl 3-hydroxybenzoate, 98%

CAS: 19438-10-9 Formule moléculaire: C8H8O3 Poids moléculaire (g/mol): 152.15 Numéro MDL: MFCD00002295 Clé InChI: YKUCHDXIBAQWSF-UHFFFAOYSA-N Synonyme: methyl m-hydroxybenzoate,3-hydroxybenzoic acid methyl ester,m-carbomethoxyphenol,methyl m-oxybenzoate,m-hydroxybenzoic acid methyl ester,benzoic acid, 3-hydroxy-, methyl ester,3-hydroxy-benzoic acid methyl ester,unii-569m9g3stj,3-methoxycarbonyl phenol,benzoic acid, m-hydroxy-, methyl ester CID PubChem: 88068 Nom IUPAC: methyl 3-hydroxybenzoate SMILES: COC(=O)C1=CC=CC(O)=C1

Poids moléculaire (g/mol) 152.15
Synonyme methyl m-hydroxybenzoate,3-hydroxybenzoic acid methyl ester,m-carbomethoxyphenol,methyl m-oxybenzoate,m-hydroxybenzoic acid methyl ester,benzoic acid, 3-hydroxy-, methyl ester,3-hydroxy-benzoic acid methyl ester,unii-569m9g3stj,3-methoxycarbonyl phenol,benzoic acid, m-hydroxy-, methyl ester
Numéro MDL MFCD00002295
CAS 19438-10-9
CID PubChem 88068
Nom IUPAC methyl 3-hydroxybenzoate
Clé InChI YKUCHDXIBAQWSF-UHFFFAOYSA-N
SMILES COC(=O)C1=CC=CC(O)=C1
Formule moléculaire C8H8O3
2

Ethyl 3,4-dihydroxybenzoate, 97%

CAS: 3943-89-3 Formule moléculaire: C9H10O4 Poids moléculaire (g/mol): 182.18 Numéro MDL: MFCD00002199 Clé InChI: KBPUBCVJHFXPOC-UHFFFAOYSA-N Synonyme: ethyl protocatechuate,3,4-dihydroxybenzoic acid ethyl ester,ethyl-3,4-dihydroxybenzoate,unii-4ygj96wtbg,benzoic acid, 3,4-dihydroxy-, ethyl ester,edhb,protocatechuic acid ethyl ester,4ygj96wtbg,3,4-dihydroxy-benzoic acid ethyl ester CID PubChem: 77547 Nom IUPAC: ethyl 3,4-dihydroxybenzoate SMILES: CCOC(=O)C1=CC=C(O)C(O)=C1

Poids moléculaire (g/mol) 182.18
Synonyme ethyl protocatechuate,3,4-dihydroxybenzoic acid ethyl ester,ethyl-3,4-dihydroxybenzoate,unii-4ygj96wtbg,benzoic acid, 3,4-dihydroxy-, ethyl ester,edhb,protocatechuic acid ethyl ester,4ygj96wtbg,3,4-dihydroxy-benzoic acid ethyl ester
Numéro MDL MFCD00002199
CAS 3943-89-3
CID PubChem 77547
Nom IUPAC ethyl 3,4-dihydroxybenzoate
Clé InChI KBPUBCVJHFXPOC-UHFFFAOYSA-N
SMILES CCOC(=O)C1=CC=C(O)C(O)=C1
Formule moléculaire C9H10O4
3

Propyl 4-hydroxybenzoate, 99+%

CAS: 94-13-3 Formule moléculaire: C10H12O3 Poids moléculaire (g/mol): 180.2 Numéro MDL: MFCD00002354 Clé InChI: QELSKZZBTMNZEB-UHFFFAOYSA-N Synonyme: propylparaben,propyl paraben,4-hydroxybenzoic acid propyl ester,propyl p-hydroxybenzoate,nipasol,nipazol,propyl butex,betacide p,propyl parahydroxybenzoate,propylparasept CID PubChem: 7175 ChEBI: CHEBI:32063 Nom IUPAC: propyl 4-hydroxybenzoate SMILES: CCCOC(=O)C1=CC=C(C=C1)O

Poids moléculaire (g/mol) 180.2
Synonyme propylparaben,propyl paraben,4-hydroxybenzoic acid propyl ester,propyl p-hydroxybenzoate,nipasol,nipazol,propyl butex,betacide p,propyl parahydroxybenzoate,propylparasept
Numéro MDL MFCD00002354
CAS 94-13-3
CID PubChem 7175
ChEBI CHEBI:32063
Nom IUPAC propyl 4-hydroxybenzoate
Clé InChI QELSKZZBTMNZEB-UHFFFAOYSA-N
SMILES CCCOC(=O)C1=CC=C(C=C1)O
Formule moléculaire C10H12O3
4

Methyl 4-hydroxybenzoate, 99%

CAS: 99-76-3 Formule moléculaire: C8H8O3 Poids moléculaire (g/mol): 152.15 Numéro MDL: MFCD00002352 Clé InChI: LXCFILQKKLGQFO-UHFFFAOYSA-N Synonyme: methylparaben,methyl paraben,methyl p-hydroxybenzoate,nipagin,methyl parahydroxybenzoate,maseptol,p-hydroxybenzoic acid methyl ester,4-hydroxybenzoic acid methyl ester,p-carbomethoxyphenol,tegosept m CID PubChem: 7456 ChEBI: CHEBI:31835 Nom IUPAC: methyl 4-hydroxybenzoate SMILES: COC(=O)C1=CC=C(C=C1)O

Poids moléculaire (g/mol) 152.15
Synonyme methylparaben,methyl paraben,methyl p-hydroxybenzoate,nipagin,methyl parahydroxybenzoate,maseptol,p-hydroxybenzoic acid methyl ester,4-hydroxybenzoic acid methyl ester,p-carbomethoxyphenol,tegosept m
Numéro MDL MFCD00002352
CAS 99-76-3
CID PubChem 7456
ChEBI CHEBI:31835
Nom IUPAC methyl 4-hydroxybenzoate
Clé InChI LXCFILQKKLGQFO-UHFFFAOYSA-N
SMILES COC(=O)C1=CC=C(C=C1)O
Formule moléculaire C8H8O3
5

3-Hydroxy-4-(methoxycarbonyl)phenylboronic acid pinacol ester, 97%

CAS: 1073371-99-9 Formule moléculaire: C14H19BO5 Poids moléculaire (g/mol): 278.11 Numéro MDL: MFCD08458200 Clé InChI: SRYGMLVCVMGUTB-UHFFFAOYSA-N Synonyme: methyl 2-hydroxy-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl benzoate,3-hydroxy-4-methoxycarbonylphenylboronic acid, pinacol ester,methyl 4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl salicylate,methyl 2-hydroxy-4-tetramethyl-1,3,2-dioxaborolan-2-yl benzoate CID PubChem: 17998928 Nom IUPAC: methyl 2-hydroxy-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate SMILES: COC(=O)C1=C(O)C=C(C=C1)B1OC(C)(C)C(C)(C)O1

Poids moléculaire (g/mol) 278.11
Synonyme methyl 2-hydroxy-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl benzoate,3-hydroxy-4-methoxycarbonylphenylboronic acid, pinacol ester,methyl 4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl salicylate,methyl 2-hydroxy-4-tetramethyl-1,3,2-dioxaborolan-2-yl benzoate
Numéro MDL MFCD08458200
CAS 1073371-99-9
CID PubChem 17998928
Nom IUPAC methyl 2-hydroxy-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate
Clé InChI SRYGMLVCVMGUTB-UHFFFAOYSA-N
SMILES COC(=O)C1=C(O)C=C(C=C1)B1OC(C)(C)C(C)(C)O1
Formule moléculaire C14H19BO5
6

Butyl 4-hydroxybenzoate, 99+%

CAS: 94-26-8 Formule moléculaire: C11H14O3 Poids moléculaire (g/mol): 194.23 Numéro MDL: MFCD00016478 Clé InChI: QFOHBWFCKVYLES-UHFFFAOYSA-N Synonyme: butylparaben,butyl paraben,butyl p-hydroxybenzoate,nipabutyl,butoben,butyl chemosept,butyl parasept,butyl tegosept,butyl butex,tegosept butyl CID PubChem: 7184 Nom IUPAC: butyl 4-hydroxybenzoate SMILES: CCCCOC(=O)C1=CC=C(C=C1)O

Poids moléculaire (g/mol) 194.23
Synonyme butylparaben,butyl paraben,butyl p-hydroxybenzoate,nipabutyl,butoben,butyl chemosept,butyl parasept,butyl tegosept,butyl butex,tegosept butyl
Numéro MDL MFCD00016478
CAS 94-26-8
CID PubChem 7184
Nom IUPAC butyl 4-hydroxybenzoate
Clé InChI QFOHBWFCKVYLES-UHFFFAOYSA-N
SMILES CCCCOC(=O)C1=CC=C(C=C1)O
Formule moléculaire C11H14O3
7

Methyl salicylate, 99%

CAS: 119-36-8 Formule moléculaire: C8H8O3 Poids moléculaire (g/mol): 152.15 Numéro MDL: MFCD00002214 Clé InChI: OSWPMRLSEDHDFF-UHFFFAOYSA-N Synonyme: methyl salicylate,wintergreen oil,gaultheria oil,betula oil,teaberry oil,sweet birch oil,oil of wintergreen,analgit,spicewood oil,2-hydroxybenzoic acid methyl ester CID PubChem: 4133 ChEBI: CHEBI:31832 Nom IUPAC: methyl 2-hydroxybenzoate SMILES: COC(=O)C1=CC=CC=C1O

Poids moléculaire (g/mol) 152.15
Synonyme methyl salicylate,wintergreen oil,gaultheria oil,betula oil,teaberry oil,sweet birch oil,oil of wintergreen,analgit,spicewood oil,2-hydroxybenzoic acid methyl ester
Numéro MDL MFCD00002214
CAS 119-36-8
CID PubChem 4133
ChEBI CHEBI:31832
Nom IUPAC methyl 2-hydroxybenzoate
Clé InChI OSWPMRLSEDHDFF-UHFFFAOYSA-N
SMILES COC(=O)C1=CC=CC=C1O
Formule moléculaire C8H8O3
8

Isopropyl 4-hydroxybenzoate, 98%

CAS: 4191-73-5 Formule moléculaire: C10H12O3 Poids moléculaire (g/mol): 180.20 Numéro MDL: MFCD00016468 Clé InChI: CMHMMKSPYOOVGI-UHFFFAOYSA-N Synonyme: isopropyl 4-hydroxybenzoate,isopropylparaben,isopropyl p-hydroxybenzoate,isopropyl paraben,p-hydroxybenzoic acid isopropyl ester,isopropylhydroxybenzoate,unii-a6eox47qk0,p-oxybenzoesaureisopropylester,4-hydroxybenzoic acid isopropyl ester,benzoic acid, 4-hydroxy-, 1-methylethyl ester CID PubChem: 20161 Nom IUPAC: propan-2-yl 4-hydroxybenzoate SMILES: CC(C)OC(=O)C1=CC=C(O)C=C1

Poids moléculaire (g/mol) 180.20
Synonyme isopropyl 4-hydroxybenzoate,isopropylparaben,isopropyl p-hydroxybenzoate,isopropyl paraben,p-hydroxybenzoic acid isopropyl ester,isopropylhydroxybenzoate,unii-a6eox47qk0,p-oxybenzoesaureisopropylester,4-hydroxybenzoic acid isopropyl ester,benzoic acid, 4-hydroxy-, 1-methylethyl ester
Numéro MDL MFCD00016468
CAS 4191-73-5
CID PubChem 20161
Nom IUPAC propan-2-yl 4-hydroxybenzoate
Clé InChI CMHMMKSPYOOVGI-UHFFFAOYSA-N
SMILES CC(C)OC(=O)C1=CC=C(O)C=C1
Formule moléculaire C10H12O3
9

n-Butyl 4-hydroxybenzoate, 99+%

CAS: 94-26-8 Formule moléculaire: C11H14O3 Poids moléculaire (g/mol): 194.23 Numéro MDL: MFCD00016478 Clé InChI: QFOHBWFCKVYLES-UHFFFAOYSA-N Synonyme: butylparaben,butyl paraben,butyl p-hydroxybenzoate,nipabutyl,butoben,butyl chemosept,butyl parasept,butyl tegosept,butyl butex,tegosept butyl CID PubChem: 7184 Nom IUPAC: butyl 4-hydroxybenzoate SMILES: CCCCOC(=O)C1=CC=C(C=C1)O

Poids moléculaire (g/mol) 194.23
Synonyme butylparaben,butyl paraben,butyl p-hydroxybenzoate,nipabutyl,butoben,butyl chemosept,butyl parasept,butyl tegosept,butyl butex,tegosept butyl
Numéro MDL MFCD00016478
CAS 94-26-8
CID PubChem 7184
Nom IUPAC butyl 4-hydroxybenzoate
Clé InChI QFOHBWFCKVYLES-UHFFFAOYSA-N
SMILES CCCCOC(=O)C1=CC=C(C=C1)O
Formule moléculaire C11H14O3
10

Methyl 3,4-dihydroxybenzoate, 97%

CAS: 2150-43-8 Formule moléculaire: C8H8O4 Poids moléculaire (g/mol): 168.15 Numéro MDL: MFCD00016437 Clé InChI: CUFLZUDASVUNOE-UHFFFAOYSA-N Synonyme: methyl protocatechuate,protocatechuic acid, methyl ester,3,4-dihydroxybenzoic acid methyl ester,protocatechuic acid methyl ester,benzoic acid, 3,4-dihydroxy-, methyl ester,3,4-dihydroxymethylbenzoate,3,4-dihydroxybenzoic acid methyl,mdhb,methyl 3,4-dihydroxy,acmc-1cfbz CID PubChem: 287064 Nom IUPAC: methyl 3,4-dihydroxybenzoate SMILES: COC(=O)C1=CC=C(O)C(O)=C1

Poids moléculaire (g/mol) 168.15
Synonyme methyl protocatechuate,protocatechuic acid, methyl ester,3,4-dihydroxybenzoic acid methyl ester,protocatechuic acid methyl ester,benzoic acid, 3,4-dihydroxy-, methyl ester,3,4-dihydroxymethylbenzoate,3,4-dihydroxybenzoic acid methyl,mdhb,methyl 3,4-dihydroxy,acmc-1cfbz
Numéro MDL MFCD00016437
CAS 2150-43-8
CID PubChem 287064
Nom IUPAC methyl 3,4-dihydroxybenzoate
Clé InChI CUFLZUDASVUNOE-UHFFFAOYSA-N
SMILES COC(=O)C1=CC=C(O)C(O)=C1
Formule moléculaire C8H8O4
11

Methyl 2-hydroxy-3-methylbenzoate, 97%

CAS: 23287-26-5 Formule moléculaire: C9H10O3 Poids moléculaire (g/mol): 166.18 Numéro MDL: MFCD00020051 Clé InChI: SUHLUMKZPUMAFP-UHFFFAOYSA-N Synonyme: methyl 3-methylsalicylate,methyl o-cresotinate,benzoic acid, 2-hydroxy-3-methyl-, methyl ester,levegal pt,2-hydroxy-3-methylbenzoic acid methyl ester,2,3-cresotic acid, methyl ester,methyl-3-methylsalicylate,methyl 2-hydroxy-3-methyl-benzoate,methyl o-cresotate,3-methylsalicylic acid methyl ester CID PubChem: 31835 Nom IUPAC: methyl 2-hydroxy-3-methylbenzoate SMILES: COC(=O)C1=CC=CC(C)=C1O

Poids moléculaire (g/mol) 166.18
Synonyme methyl 3-methylsalicylate,methyl o-cresotinate,benzoic acid, 2-hydroxy-3-methyl-, methyl ester,levegal pt,2-hydroxy-3-methylbenzoic acid methyl ester,2,3-cresotic acid, methyl ester,methyl-3-methylsalicylate,methyl 2-hydroxy-3-methyl-benzoate,methyl o-cresotate,3-methylsalicylic acid methyl ester
Numéro MDL MFCD00020051
CAS 23287-26-5
CID PubChem 31835
Nom IUPAC methyl 2-hydroxy-3-methylbenzoate
Clé InChI SUHLUMKZPUMAFP-UHFFFAOYSA-N
SMILES COC(=O)C1=CC=CC(C)=C1O
Formule moléculaire C9H10O3
12

n-Octyl 4-hydroxybenzoate, 98%

CAS: 1219-38-1 Formule moléculaire: C15H22O3 Poids moléculaire (g/mol): 250.34 Numéro MDL: MFCD00016482 Clé InChI: RIKCMEDSBFQFAL-UHFFFAOYSA-N Synonyme: octylparaben,n-octyl 4-hydroxybenzoate,octyl paraben,octyl p-hydroxybenzoate,p-hydroxybenzoic acid octyl ester,benzoic acid, 4-hydroxy-, octyl ester,p-oxybenzoesaureoctylester,4-hydroxybenzoic acid n-octyl ester,unii-4uvk431k6b,p-oxybenzoesaureoctylester german CID PubChem: 14642 Nom IUPAC: octyl 4-hydroxybenzoate SMILES: CCCCCCCCOC(=O)C1=CC=C(O)C=C1

Poids moléculaire (g/mol) 250.34
Synonyme octylparaben,n-octyl 4-hydroxybenzoate,octyl paraben,octyl p-hydroxybenzoate,p-hydroxybenzoic acid octyl ester,benzoic acid, 4-hydroxy-, octyl ester,p-oxybenzoesaureoctylester,4-hydroxybenzoic acid n-octyl ester,unii-4uvk431k6b,p-oxybenzoesaureoctylester german
Numéro MDL MFCD00016482
CAS 1219-38-1
CID PubChem 14642
Nom IUPAC octyl 4-hydroxybenzoate
Clé InChI RIKCMEDSBFQFAL-UHFFFAOYSA-N
SMILES CCCCCCCCOC(=O)C1=CC=C(O)C=C1
Formule moléculaire C15H22O3
13

Methyl salicylate, 98%

CAS: 119-36-8 Formule moléculaire: C8H8O3 Poids moléculaire (g/mol): 152.149 Numéro MDL: MFCD00002214 Clé InChI: OSWPMRLSEDHDFF-UHFFFAOYSA-N Synonyme: methyl salicylate,wintergreen oil,gaultheria oil,betula oil,teaberry oil,sweet birch oil,oil of wintergreen,analgit,spicewood oil,2-hydroxybenzoic acid methyl ester CID PubChem: 4133 ChEBI: CHEBI:31832 Nom IUPAC: methyl 2-hydroxybenzoate SMILES: COC(=O)C1=CC=CC=C1O

Poids moléculaire (g/mol) 152.149
Synonyme methyl salicylate,wintergreen oil,gaultheria oil,betula oil,teaberry oil,sweet birch oil,oil of wintergreen,analgit,spicewood oil,2-hydroxybenzoic acid methyl ester
Numéro MDL MFCD00002214
CAS 119-36-8
CID PubChem 4133
ChEBI CHEBI:31832
Nom IUPAC methyl 2-hydroxybenzoate
Clé InChI OSWPMRLSEDHDFF-UHFFFAOYSA-N
SMILES COC(=O)C1=CC=CC=C1O
Formule moléculaire C8H8O3
14

n-Pentyl 4-hydroxybenzoate, 98%

CAS: 6521-29-5 Formule moléculaire: C12H16O3 Poids moléculaire (g/mol): 208.26 Numéro MDL: MFCD00016479 Clé InChI: ZNSSPLQZSUWFJT-UHFFFAOYSA-N CID PubChem: 23019 Nom IUPAC: pentyl 4-hydroxybenzoate SMILES: CCCCCOC(=O)C1=CC=C(O)C=C1

Poids moléculaire (g/mol) 208.26
Numéro MDL MFCD00016479
CAS 6521-29-5
CID PubChem 23019
Nom IUPAC pentyl 4-hydroxybenzoate
Clé InChI ZNSSPLQZSUWFJT-UHFFFAOYSA-N
SMILES CCCCCOC(=O)C1=CC=C(O)C=C1
Formule moléculaire C12H16O3
15

Methyl 4-fluoro-3-hydroxybenzoate, 98+%

CAS: 214822-96-5 Formule moléculaire: C8H7FO3 Poids moléculaire (g/mol): 170.139 Numéro MDL: MFCD06797457 Clé InChI: CUGWNEOTLGLGDG-UHFFFAOYSA-N Synonyme: 4-fluoro-3-hydroxybenzoic acid methyl ester,benzoic acid, 4-fluoro-3-hydroxy-, methyl ester,pubchem3567,acmc-209fky,methyl4-fluoro-3-hydroxybenzoate,methyl 4-fluoranyl-3-oxidanyl-benzoate,3-hydroxy-4-fluorobenzoic acid methyl ester,4-fluoro-3-hydroxy-benzoic acid methyl ester,benzoic acid,4-fluoro-3-hydroxy-, methyl ester CID PubChem: 12016892 Nom IUPAC: methyl 4-fluoro-3-hydroxybenzoate SMILES: COC(=O)C1=CC(=C(C=C1)F)O

Poids moléculaire (g/mol) 170.139
Synonyme 4-fluoro-3-hydroxybenzoic acid methyl ester,benzoic acid, 4-fluoro-3-hydroxy-, methyl ester,pubchem3567,acmc-209fky,methyl4-fluoro-3-hydroxybenzoate,methyl 4-fluoranyl-3-oxidanyl-benzoate,3-hydroxy-4-fluorobenzoic acid methyl ester,4-fluoro-3-hydroxy-benzoic acid methyl ester,benzoic acid,4-fluoro-3-hydroxy-, methyl ester
Numéro MDL MFCD06797457
CAS 214822-96-5
CID PubChem 12016892
Nom IUPAC methyl 4-fluoro-3-hydroxybenzoate
Clé InChI CUGWNEOTLGLGDG-UHFFFAOYSA-N
SMILES COC(=O)C1=CC(=C(C=C1)F)O
Formule moléculaire C8H7FO3