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Carboxylic acid esters

Organic compounds that are directly derived from carboxylic acid, and contain an ester functional group substitution; ester groups contain an oxygen atom that is bonded to two carbon atoms or organic groups via single bonds.
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1 – 15 de 518 résultats
1

Methyl pyruvate, 94%

CAS: 600-22-6 Formule moléculaire: C4H6O3 Poids moléculaire (g/mol): 102.09 Numéro MDL: MFCD00008754 Clé InChI: CWKLZLBVOJRSOM-UHFFFAOYSA-N Synonyme: methyl pyruvate,pyruvic acid, methyl ester,pyruvic acid methyl ester,methyl 2-oxopropionate,propanoic acid, 2-oxo-, methyl ester,methyl-pyruvate,methylglyoxylic acid methyl ester,unii-3kjm65g5xl,3kjm65g5xl,2-oxo-propionic acid methyl ester CID PubChem: 11748 ChEBI: CHEBI:51850 Nom IUPAC: methyl 2-oxopropanoate SMILES: CC(=O)C(=O)OC

Poids moléculaire (g/mol) 102.09
Synonyme methyl pyruvate,pyruvic acid, methyl ester,pyruvic acid methyl ester,methyl 2-oxopropionate,propanoic acid, 2-oxo-, methyl ester,methyl-pyruvate,methylglyoxylic acid methyl ester,unii-3kjm65g5xl,3kjm65g5xl,2-oxo-propionic acid methyl ester
Numéro MDL MFCD00008754
CAS 600-22-6
CID PubChem 11748
ChEBI CHEBI:51850
Nom IUPAC methyl 2-oxopropanoate
Clé InChI CWKLZLBVOJRSOM-UHFFFAOYSA-N
SMILES CC(=O)C(=O)OC
Formule moléculaire C4H6O3
2

Benzyl cinnamate, 99%

CAS: 103-41-3 Formule moléculaire: C16H14O2 Poids moléculaire (g/mol): 238.29 Numéro MDL: MFCD00004789,MFCD00004789,MFCD00004789 Clé InChI: NGHOLYJTSCBCGC-VAWYXSNFSA-N Synonyme: benzyl alcohol cinnamic ester,benzylcinnamate,benzyl alcohol, cinnamate,wln: r1u1vo1r,benzyl .gamma.-phenylacrylate,benzyl cis-cinnamate,benzyl z-cinnamate,2-propenoic acid, 3-phenyl-, phenylmethyl ester,z-benzyl 3-phenylacrylate,cinnamic acid, benzyl ester, z CID PubChem: 15558051 Nom IUPAC: benzyl (Z)-3-phenylprop-2-enoate SMILES: O=C(OCC1=CC=CC=C1)\C=C\C1=CC=CC=C1

Poids moléculaire (g/mol) 238.29
Synonyme benzyl alcohol cinnamic ester,benzylcinnamate,benzyl alcohol, cinnamate,wln: r1u1vo1r,benzyl .gamma.-phenylacrylate,benzyl cis-cinnamate,benzyl z-cinnamate,2-propenoic acid, 3-phenyl-, phenylmethyl ester,z-benzyl 3-phenylacrylate,cinnamic acid, benzyl ester, z
Numéro MDL MFCD00004789,MFCD00004789,MFCD00004789
CAS 103-41-3
CID PubChem 15558051
Nom IUPAC benzyl (Z)-3-phenylprop-2-enoate
Clé InChI NGHOLYJTSCBCGC-VAWYXSNFSA-N
SMILES O=C(OCC1=CC=CC=C1)\C=C\C1=CC=CC=C1
Formule moléculaire C16H14O2
3

Methyl o-toluate, 99%

CAS: 89-71-4 Formule moléculaire: C9H10O2 Poids moléculaire (g/mol): 150.177 Numéro MDL: MFCD00008428 Clé InChI: WVWZECQNFWFVFW-UHFFFAOYSA-N Synonyme: methyl o-toluate,methyl orthotoluate,o-toluic acid, methyl ester,methyl o-methylbenzoate,methyl toluate,benzoic acid, 2-methyl-, methyl ester,2-methylbenzoic acid methyl ester,o-toluic acid methyl ester,methyl-o-methyl benzoate,2-methyl methylbenzoate CID PubChem: 33094 Nom IUPAC: methyl 2-methylbenzoate SMILES: CC1=CC=CC=C1C(=O)OC

Poids moléculaire (g/mol) 150.177
Synonyme methyl o-toluate,methyl orthotoluate,o-toluic acid, methyl ester,methyl o-methylbenzoate,methyl toluate,benzoic acid, 2-methyl-, methyl ester,2-methylbenzoic acid methyl ester,o-toluic acid methyl ester,methyl-o-methyl benzoate,2-methyl methylbenzoate
Numéro MDL MFCD00008428
CAS 89-71-4
CID PubChem 33094
Nom IUPAC methyl 2-methylbenzoate
Clé InChI WVWZECQNFWFVFW-UHFFFAOYSA-N
SMILES CC1=CC=CC=C1C(=O)OC
Formule moléculaire C9H10O2
4

2(5H)-Furanone, 96%

CAS: 497-23-4 Formule moléculaire: C4H4O2 Poids moléculaire (g/mol): 84.07 Numéro MDL: MFCD00005376 Clé InChI: VIHAEDVKXSOUAT-UHFFFAOYSA-N Synonyme: 2 5h-furanone,furan-2 5h-one,butenolide,2-butenolide,gamma-crotonolactone,2-buten-4-olide,isocrotonolactone,2-oxo-2,5-dihydrofuran,crotonolactone,2-5h-furanone CID PubChem: 10341 ChEBI: CHEBI:38118 Nom IUPAC: 2H-furan-5-one SMILES: O=C1OCC=C1

Poids moléculaire (g/mol) 84.07
Synonyme 2 5h-furanone,furan-2 5h-one,butenolide,2-butenolide,gamma-crotonolactone,2-buten-4-olide,isocrotonolactone,2-oxo-2,5-dihydrofuran,crotonolactone,2-5h-furanone
Numéro MDL MFCD00005376
CAS 497-23-4
CID PubChem 10341
ChEBI CHEBI:38118
Nom IUPAC 2H-furan-5-one
Clé InChI VIHAEDVKXSOUAT-UHFFFAOYSA-N
SMILES O=C1OCC=C1
Formule moléculaire C4H4O2
5

1-(Trifluoromethyl)vinyl acetate, 97%

CAS: 2247-91-8 Formule moléculaire: C5H5F3O2 Poids moléculaire (g/mol): 154.088 Numéro MDL: MFCD00040844 Clé InChI: VOKGSDIHTCTXDS-UHFFFAOYSA-N Synonyme: 1-trifluoromethyl vinyl acetate,1-trifluoromethyl ethenyl acetate,1-propen-2-ol, 3,3,3-trifluoro-, acetate,1-propen-2-ol, 3,3,3-trifluoro-, 2-acetate,trifluoroacetone enol acetate,trifluoroacetone enolacetate,alpha-trifluoromethylvinyl acetate,acmc-1cjli,3,3,3-trifluoropropen-2-yl acetate,alpa-trifluoromethyl vinyl acetate CID PubChem: 75254 Nom IUPAC: 3,3,3-trifluoroprop-1-en-2-yl acetate SMILES: CC(=O)OC(=C)C(F)(F)F

Poids moléculaire (g/mol) 154.088
Synonyme 1-trifluoromethyl vinyl acetate,1-trifluoromethyl ethenyl acetate,1-propen-2-ol, 3,3,3-trifluoro-, acetate,1-propen-2-ol, 3,3,3-trifluoro-, 2-acetate,trifluoroacetone enol acetate,trifluoroacetone enolacetate,alpha-trifluoromethylvinyl acetate,acmc-1cjli,3,3,3-trifluoropropen-2-yl acetate,alpa-trifluoromethyl vinyl acetate
Numéro MDL MFCD00040844
CAS 2247-91-8
CID PubChem 75254
Nom IUPAC 3,3,3-trifluoroprop-1-en-2-yl acetate
Clé InChI VOKGSDIHTCTXDS-UHFFFAOYSA-N
SMILES CC(=O)OC(=C)C(F)(F)F
Formule moléculaire C5H5F3O2
6

Diethyl maleate, 97%

CAS: 141-05-9 Formule moléculaire: C8H12O4 Poids moléculaire (g/mol): 172.18 Numéro MDL: MFCD00009191 Clé InChI: IEPRKVQEAMIZSS-WAYWQWQTSA-N Synonyme: diethyl maleate,ethyl maleate,maleic acid, diethyl ester,diethylmaleate,maleic acid diethyl ester,2-butenedioic acid z-, diethyl ester,diethyl z-but-2-enedioate,diethyl 2z-but-2-enedioate,unii-g81wqb56ol,ccris 941 CID PubChem: 5271566 ChEBI: CHEBI:68508 Nom IUPAC: diethyl (Z)-but-2-enedioate SMILES: CCOC(=O)C=CC(=O)OCC

Poids moléculaire (g/mol) 172.18
Synonyme diethyl maleate,ethyl maleate,maleic acid, diethyl ester,diethylmaleate,maleic acid diethyl ester,2-butenedioic acid z-, diethyl ester,diethyl z-but-2-enedioate,diethyl 2z-but-2-enedioate,unii-g81wqb56ol,ccris 941
Numéro MDL MFCD00009191
CAS 141-05-9
CID PubChem 5271566
ChEBI CHEBI:68508
Nom IUPAC diethyl (Z)-but-2-enedioate
Clé InChI IEPRKVQEAMIZSS-WAYWQWQTSA-N
SMILES CCOC(=O)C=CC(=O)OCC
Formule moléculaire C8H12O4
7

trans-Ethyl crotonate, 96%

CAS: 623-70-1 Formule moléculaire: C6H10O2 Poids moléculaire (g/mol): 114.14 Numéro MDL: MFCD00009289 Clé InChI: ZFDIRQKJPRINOQ-HWKANZROSA-N Synonyme: ethyl crotonate,ethyl trans-crotonate,ethyl e-but-2-enoate,ethyl trans-2-butenoate,crotonic acid, ethyl ester,2-butenoic acid, ethyl ester, 2e,ethyl e-2-butenoate,2-butenoic acid, ethyl ester,ethyl 2e-but-2-enoate,crotonic acid, ethyl ester, e CID PubChem: 429065 Nom IUPAC: ethyl (E)-but-2-enoate SMILES: CCOC(=O)\C=C\C

Poids moléculaire (g/mol) 114.14
Synonyme ethyl crotonate,ethyl trans-crotonate,ethyl e-but-2-enoate,ethyl trans-2-butenoate,crotonic acid, ethyl ester,2-butenoic acid, ethyl ester, 2e,ethyl e-2-butenoate,2-butenoic acid, ethyl ester,ethyl 2e-but-2-enoate,crotonic acid, ethyl ester, e
Numéro MDL MFCD00009289
CAS 623-70-1
CID PubChem 429065
Nom IUPAC ethyl (E)-but-2-enoate
Clé InChI ZFDIRQKJPRINOQ-HWKANZROSA-N
SMILES CCOC(=O)\C=C\C
Formule moléculaire C6H10O2
8

Ethyl cinnamate, 98% trans

CAS: 103-36-6 Formule moléculaire: C11H12O2 Poids moléculaire (g/mol): 176.21 Clé InChI: KBEBGUQPQBELIU-CMDGGOBGSA-N Synonyme: ethyl cinnamate,ethyl 3-phenylacrylate,ethylcinnamate,cinnamic acid ethyl ester,ethylcinnamoate,cinnamic acid, ethyl ester,ethyl trans-cinnamate,e-ethyl cinnamate,ethyl 3-phenyl-2-propenoate,ethyl benzylideneacetate CID PubChem: 637758 ChEBI: CHEBI:4895 Nom IUPAC: ethyl (E)-3-phenylprop-2-enoate SMILES: CCOC(=O)C=CC1=CC=CC=C1

Poids moléculaire (g/mol) 176.21
Synonyme ethyl cinnamate,ethyl 3-phenylacrylate,ethylcinnamate,cinnamic acid ethyl ester,ethylcinnamoate,cinnamic acid, ethyl ester,ethyl trans-cinnamate,e-ethyl cinnamate,ethyl 3-phenyl-2-propenoate,ethyl benzylideneacetate
CAS 103-36-6
CID PubChem 637758
ChEBI CHEBI:4895
Nom IUPAC ethyl (E)-3-phenylprop-2-enoate
Clé InChI KBEBGUQPQBELIU-CMDGGOBGSA-N
SMILES CCOC(=O)C=CC1=CC=CC=C1
Formule moléculaire C11H12O2
9

Glycidyl methacrylate, 97%, stabilized

CAS: 106-91-2 Clé InChI: VOZRXNHHFUQHIL-UHFFFAOYSA-N Synonyme: glycidyl methacrylate,2,3-epoxypropyl methacrylate,sy-monomer g,glycidol methacrylate,acriester g,blemmer g,blemmer gma,light ester g,glycidylmethacrylate,2-methacryloxy methyl oxirane CID PubChem: 7837 Nom IUPAC: oxiran-2-ylmethyl 2-methylprop-2-enoate SMILES: CC(=C)C(=O)OCC1CO1

Synonyme glycidyl methacrylate,2,3-epoxypropyl methacrylate,sy-monomer g,glycidol methacrylate,acriester g,blemmer g,blemmer gma,light ester g,glycidylmethacrylate,2-methacryloxy methyl oxirane
CAS 106-91-2
CID PubChem 7837
Nom IUPAC oxiran-2-ylmethyl 2-methylprop-2-enoate
Clé InChI VOZRXNHHFUQHIL-UHFFFAOYSA-N
SMILES CC(=C)C(=O)OCC1CO1
10

Ethyl indole-3-acrylate, 97%

CAS: 15181-86-9 Formule moléculaire: C13H13NO2 Poids moléculaire (g/mol): 215.252 Numéro MDL: MFCD00051947 Clé InChI: OQJSITNIWIYWPU-FPLPWBNLSA-N Synonyme: ethyl 2z-3-1h-indol-3-yl prop-2-enoate CID PubChem: 13863197 Nom IUPAC: ethyl (Z)-3-(1H-indol-3-yl)prop-2-enoate SMILES: CCOC(=O)C=CC1=CNC2=CC=CC=C21

Poids moléculaire (g/mol) 215.252
Synonyme ethyl 2z-3-1h-indol-3-yl prop-2-enoate
Numéro MDL MFCD00051947
CAS 15181-86-9
CID PubChem 13863197
Nom IUPAC ethyl (Z)-3-(1H-indol-3-yl)prop-2-enoate
Clé InChI OQJSITNIWIYWPU-FPLPWBNLSA-N
SMILES CCOC(=O)C=CC1=CNC2=CC=CC=C21
Formule moléculaire C13H13NO2
11

Methyl 2-octynoate, 98%

CAS: 111-12-6 Formule moléculaire: C9H14O2 Poids moléculaire (g/mol): 154.209 Numéro MDL: MFCD00009530 Clé InChI: FRLZQXRXIKQFNS-UHFFFAOYSA-N Synonyme: methyl 2-octynoate,folione,methyl heptine carbonate,methyl 2-octynate,methyl 2-octinate,2-octynoic acid, methyl ester,vert de violette, artificial,methyl hept-1-yne-1-carboxylate,methyl pentylacetylenecarboxylate,unii-0ttp6yt2t3 CID PubChem: 8092 Nom IUPAC: methyl oct-2-ynoate SMILES: CCCCCC#CC(=O)OC

Poids moléculaire (g/mol) 154.209
Synonyme methyl 2-octynoate,folione,methyl heptine carbonate,methyl 2-octynate,methyl 2-octinate,2-octynoic acid, methyl ester,vert de violette, artificial,methyl hept-1-yne-1-carboxylate,methyl pentylacetylenecarboxylate,unii-0ttp6yt2t3
Numéro MDL MFCD00009530
CAS 111-12-6
CID PubChem 8092
Nom IUPAC methyl oct-2-ynoate
Clé InChI FRLZQXRXIKQFNS-UHFFFAOYSA-N
SMILES CCCCCC#CC(=O)OC
Formule moléculaire C9H14O2
12

Methyl 2,6-dichlorophenylacetate, 99%

CAS: 54551-83-6 Formule moléculaire: C9H8Cl2O2 Poids moléculaire (g/mol): 219.07 Numéro MDL: MFCD00191640 Clé InChI: FCWRUYPZZJPCCG-UHFFFAOYSA-N Synonyme: methyl 2,6-dichlorophenylacetate,methyl 2-2,6-dichlorophenyl acetate,2,6-dichlorophenylacetic acid methyl ester,benzeneacetic acid,2,6-dichloro-, methyl ester,benzeneacetic acid, 2,6-dichloro-, methyl ester,acmc-209lhf,methyl2,6-dichlorophenylacetate,guanfacine methyl ester impurity,methyl 2,6-dichlorophenyl acetate,2,6-dichloro-phenylacetic acid methyl ester CID PubChem: 2734107 Nom IUPAC: methyl 2-(2,6-dichlorophenyl)acetate SMILES: COC(=O)CC1=C(C=CC=C1Cl)Cl

Poids moléculaire (g/mol) 219.07
Synonyme methyl 2,6-dichlorophenylacetate,methyl 2-2,6-dichlorophenyl acetate,2,6-dichlorophenylacetic acid methyl ester,benzeneacetic acid,2,6-dichloro-, methyl ester,benzeneacetic acid, 2,6-dichloro-, methyl ester,acmc-209lhf,methyl2,6-dichlorophenylacetate,guanfacine methyl ester impurity,methyl 2,6-dichlorophenyl acetate,2,6-dichloro-phenylacetic acid methyl ester
Numéro MDL MFCD00191640
CAS 54551-83-6
CID PubChem 2734107
Nom IUPAC methyl 2-(2,6-dichlorophenyl)acetate
Clé InChI FCWRUYPZZJPCCG-UHFFFAOYSA-N
SMILES COC(=O)CC1=C(C=CC=C1Cl)Cl
Formule moléculaire C9H8Cl2O2
13

2-Ethylhexyl methacrylate, 98%, stab. with 4-methoxyphenol

CAS: 688-84-6 Formule moléculaire: C12H22O2 Poids moléculaire (g/mol): 198.306 Numéro MDL: MFCD00009494 Clé InChI: WDQMWEYDKDCEHT-UHFFFAOYSA-N Synonyme: 2-ethylhexyl methacrylate,2-ethyl-1-hexyl methacrylate,2-ethylhexyl methacryate,2-propenoic acid, 2-methyl-, 2-ethylhexyl ester,methacrylic acid 2-ethylhexyl ester,methacrylic acid, 2-ethylhexyl ester,methacrylate, 2-ethylisohexy,2-ethylhexylmethacrylate,dsstox_cid_7293,dsstox_rid_78391 CID PubChem: 12713 Nom IUPAC: 2-ethylhexyl 2-methylprop-2-enoate SMILES: CCCCC(CC)COC(=O)C(=C)C

Poids moléculaire (g/mol) 198.306
Synonyme 2-ethylhexyl methacrylate,2-ethyl-1-hexyl methacrylate,2-ethylhexyl methacryate,2-propenoic acid, 2-methyl-, 2-ethylhexyl ester,methacrylic acid 2-ethylhexyl ester,methacrylic acid, 2-ethylhexyl ester,methacrylate, 2-ethylisohexy,2-ethylhexylmethacrylate,dsstox_cid_7293,dsstox_rid_78391
Numéro MDL MFCD00009494
CAS 688-84-6
CID PubChem 12713
Nom IUPAC 2-ethylhexyl 2-methylprop-2-enoate
Clé InChI WDQMWEYDKDCEHT-UHFFFAOYSA-N
SMILES CCCCC(CC)COC(=O)C(=C)C
Formule moléculaire C12H22O2
14

L-Ascorbic acid sodium salt, 99%

CAS: 134-03-2 Formule moléculaire: C6H7NaO6 Poids moléculaire (g/mol): 198.11 Numéro MDL: MFCD00082340 Clé InChI: IFVCRSPJFHGFCG-HXPAKLQESA-N Synonyme: sodium ascorbate,l-ascorbic acid sodium salt,sodium l-ascorbate,vitamin c sodium,ascorbicin,sodascorbate,cebitate,aminofenitrooxon,natrii ascorbas,monosodium l-ascorbate CID PubChem: 131674100 Nom IUPAC: sodium 5-[(1S)-1,2-dihydroxyethyl]-3-hydroxy-2,4-dioxooxolan-3-ide SMILES: [Na+].OC[C@H](O)C1OC(=O)[C-](O)C1=O

Poids moléculaire (g/mol) 198.11
Synonyme sodium ascorbate,l-ascorbic acid sodium salt,sodium l-ascorbate,vitamin c sodium,ascorbicin,sodascorbate,cebitate,aminofenitrooxon,natrii ascorbas,monosodium l-ascorbate
Numéro MDL MFCD00082340
CAS 134-03-2
CID PubChem 131674100
Nom IUPAC sodium 5-[(1S)-1,2-dihydroxyethyl]-3-hydroxy-2,4-dioxooxolan-3-ide
Clé InChI IFVCRSPJFHGFCG-HXPAKLQESA-N
SMILES [Na+].OC[C@H](O)C1OC(=O)[C-](O)C1=O
Formule moléculaire C6H7NaO6
15

Vinyl acetate, 99+%, stabilized

CAS: 108-05-4 Formule moléculaire: C4H6O2 Poids moléculaire (g/mol): 86.09 Clé InChI: XTXRWKRVRITETP-UHFFFAOYSA-N Synonyme: vinyl acetate,acetic acid ethenyl ester,acetic acid vinyl ester,ethenyl ethanoate,1-acetoxyethylene,vinyl ethanoate,acetoxyethene,vinylacetat,vinyl acetate monomer,vinyl a monomer CID PubChem: 7904 ChEBI: CHEBI:46916 Nom IUPAC: ethenyl acetate SMILES: CC(=O)OC=C

Poids moléculaire (g/mol) 86.09
Synonyme vinyl acetate,acetic acid ethenyl ester,acetic acid vinyl ester,ethenyl ethanoate,1-acetoxyethylene,vinyl ethanoate,acetoxyethene,vinylacetat,vinyl acetate monomer,vinyl a monomer
CAS 108-05-4
CID PubChem 7904
ChEBI CHEBI:46916
Nom IUPAC ethenyl acetate
Clé InChI XTXRWKRVRITETP-UHFFFAOYSA-N
SMILES CC(=O)OC=C
Formule moléculaire C4H6O2