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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 524 résultats
1

Methyl 4-chlorocinnamate, 99%

CAS: 7560-44-3 Formule moléculaire: C10H9ClO2 Poids moléculaire (g/mol): 196.63 Numéro MDL: MFCD00075790 Clé InChI: IIBXQGYKZKOORG-QPJJXVBHSA-N Synonyme: methyl 4-chlorocinnamate,methyl p-chlorocinnamate,methyl 3-4-chlorophenyl acrylate,4-chlorocinnamic acid methyl ester,cinnamic acid, p-chloro-, methyl ester,2-propenoic acid, 3-4-chlorophenyl-, methyl ester,methyl e-3-4-chlorophenyl prop-2-enoate,e-methyl 3-4-chlorophenyl acrylate,methyl 2e-3-4-chlorophenyl prop-2-enoate,methyl 3-4-chlorophenyl prop-2-enoate CID PubChem: 5314314 Nom IUPAC: methyl (E)-3-(4-chlorophenyl)prop-2-enoate SMILES: COC(=O)C=CC1=CC=C(C=C1)Cl

Poids moléculaire (g/mol) 196.63
Synonyme methyl 4-chlorocinnamate,methyl p-chlorocinnamate,methyl 3-4-chlorophenyl acrylate,4-chlorocinnamic acid methyl ester,cinnamic acid, p-chloro-, methyl ester,2-propenoic acid, 3-4-chlorophenyl-, methyl ester,methyl e-3-4-chlorophenyl prop-2-enoate,e-methyl 3-4-chlorophenyl acrylate,methyl 2e-3-4-chlorophenyl prop-2-enoate,methyl 3-4-chlorophenyl prop-2-enoate
Numéro MDL MFCD00075790
CAS 7560-44-3
CID PubChem 5314314
Nom IUPAC methyl (E)-3-(4-chlorophenyl)prop-2-enoate
Clé InChI IIBXQGYKZKOORG-QPJJXVBHSA-N
SMILES COC(=O)C=CC1=CC=C(C=C1)Cl
Formule moléculaire C10H9ClO2
2

Methyl 1-cyclohexene-1-carboxylate, 97%

CAS: 18448-47-0 Formule moléculaire: C8H12O2 Poids moléculaire (g/mol): 140.182 Numéro MDL: MFCD00001544 Clé InChI: KXPWRCPEMHIZGU-UHFFFAOYSA-N Synonyme: methyl 1-cyclohexene-1-carboxylate,methyl cyclohex-1-enecarboxylate,methyl 1-cyclohexenecarboxylate,methyl cyclohex-1-ene-1-carboxylate,1-cyclohexene-1-carboxylic acid, methyl ester,cyclohexenecarboxylic acid, methyl ester,cyclohexene-1-carboxylic acid methyl ester,methyl1-cyclohexene-1-carboxylate,pubchem11031,1-carbomethoxy cyclohexene CID PubChem: 87647 Nom IUPAC: methyl cyclohexene-1-carboxylate SMILES: COC(=O)C1=CCCCC1

Poids moléculaire (g/mol) 140.182
Synonyme methyl 1-cyclohexene-1-carboxylate,methyl cyclohex-1-enecarboxylate,methyl 1-cyclohexenecarboxylate,methyl cyclohex-1-ene-1-carboxylate,1-cyclohexene-1-carboxylic acid, methyl ester,cyclohexenecarboxylic acid, methyl ester,cyclohexene-1-carboxylic acid methyl ester,methyl1-cyclohexene-1-carboxylate,pubchem11031,1-carbomethoxy cyclohexene
Numéro MDL MFCD00001544
CAS 18448-47-0
CID PubChem 87647
Nom IUPAC methyl cyclohexene-1-carboxylate
Clé InChI KXPWRCPEMHIZGU-UHFFFAOYSA-N
SMILES COC(=O)C1=CCCCC1
Formule moléculaire C8H12O2
3

(1S,2R)-cis-4-Cyclohexene-1,2-dicarboxylic acid 1-monomethyl ester, 98%

CAS: 88335-93-7 Formule moléculaire: C9H12O4 Poids moléculaire (g/mol): 184.19 Numéro MDL: MFCD00757425,MFCD00075490 Clé InChI: MYYLMIDEMAPSGH-UHFFFAOYNA-N Synonyme: 1s,2r-1-methyl cis-1,2,3,6-tetrahydrophthalate,1r,6s-6-methoxycarbonyl cyclohex-3-enecarboxylic acid,1r,6s-6-methoxycarbonylcyclohex-3-ene-1-carboxylic acid,1r,6s-6-methoxycarbonyl cyclohex-3-ene-1-carboxylic acid,1s,2r-1-methyl cis-4-cyclohexene-1,2-dicarboxylate,1r,6s-6-methoxycarbonyl-1-cyclohex-3-enecarboxylic acid,1s,2r-1-methylcis-1,2,3,6-tetrahydrophthalate,2-hydrogen 1-methyl 1s,2r-1,2,3,6-tetrahydrophthalate,1 r,6s-6-methoxycarbonyl-3-cyclohexene-1-carboxylic acid,1r, 2s-2-methoxycarbonylcyclohex-4-ene-1-carboxylic acid CID PubChem: 5325907 Nom IUPAC: (1R,6S)-6-methoxycarbonylcyclohex-3-ene-1-carboxylic acid SMILES: COC(=O)C1CC=CCC1C(O)=O

Poids moléculaire (g/mol) 184.19
Synonyme 1s,2r-1-methyl cis-1,2,3,6-tetrahydrophthalate,1r,6s-6-methoxycarbonyl cyclohex-3-enecarboxylic acid,1r,6s-6-methoxycarbonylcyclohex-3-ene-1-carboxylic acid,1r,6s-6-methoxycarbonyl cyclohex-3-ene-1-carboxylic acid,1s,2r-1-methyl cis-4-cyclohexene-1,2-dicarboxylate,1r,6s-6-methoxycarbonyl-1-cyclohex-3-enecarboxylic acid,1s,2r-1-methylcis-1,2,3,6-tetrahydrophthalate,2-hydrogen 1-methyl 1s,2r-1,2,3,6-tetrahydrophthalate,1 r,6s-6-methoxycarbonyl-3-cyclohexene-1-carboxylic acid,1r, 2s-2-methoxycarbonylcyclohex-4-ene-1-carboxylic acid
Numéro MDL MFCD00757425,MFCD00075490
CAS 88335-93-7
CID PubChem 5325907
Nom IUPAC (1R,6S)-6-methoxycarbonylcyclohex-3-ene-1-carboxylic acid
Clé InChI MYYLMIDEMAPSGH-UHFFFAOYNA-N
SMILES COC(=O)C1CC=CCC1C(O)=O
Formule moléculaire C9H12O4
4

Dimethyl maleate, 96%

CAS: 624-48-6 Formule moléculaire: C6H8O4 Poids moléculaire (g/mol): 144.126 Numéro MDL: MFCD00008459 Clé InChI: LDCRTTXIJACKKU-ARJAWSKDSA-N Synonyme: dimethyl maleate,maleic acid, dimethyl ester,methyl maleate,sipomer dmm,maleic acid dimethyl ester,dimethyl cis-butenedioate,2-butenedioic acid z-, dimethyl ester,dimethyl cis-ethylenedicarboxylate,2-butenedioic acid 2z-, dimethyl ester,2-butenedioic acid, dimethyl ester, z CID PubChem: 5271565 ChEBI: CHEBI:35460 Nom IUPAC: dimethyl (Z)-but-2-enedioate SMILES: COC(=O)C=CC(=O)OC

Poids moléculaire (g/mol) 144.126
Synonyme dimethyl maleate,maleic acid, dimethyl ester,methyl maleate,sipomer dmm,maleic acid dimethyl ester,dimethyl cis-butenedioate,2-butenedioic acid z-, dimethyl ester,dimethyl cis-ethylenedicarboxylate,2-butenedioic acid 2z-, dimethyl ester,2-butenedioic acid, dimethyl ester, z
Numéro MDL MFCD00008459
CAS 624-48-6
CID PubChem 5271565
ChEBI CHEBI:35460
Nom IUPAC dimethyl (Z)-but-2-enedioate
Clé InChI LDCRTTXIJACKKU-ARJAWSKDSA-N
SMILES COC(=O)C=CC(=O)OC
Formule moléculaire C6H8O4
5

Methyl glycolate, 98%

CAS: 96-35-5 Formule moléculaire: C3H6O3 Poids moléculaire (g/mol): 90.078 Numéro MDL: MFCD00004667 Clé InChI: GSJFXBNYJCXDGI-UHFFFAOYSA-N Synonyme: methyl glycolate,methyl hydroxyacetate,acetic acid, hydroxy-, methyl ester,glycolic acid, methyl ester,acetic acid, 2-hydroxy-, methyl ester,glycolic acid methyl ester,unii-7g7r729ej0,hydroxyacetic acid methyl ester,glycolic acid methyl,methyl2-hydroxyethanoate CID PubChem: 66774 Nom IUPAC: methyl 2-hydroxyacetate SMILES: COC(=O)CO

Poids moléculaire (g/mol) 90.078
Synonyme methyl glycolate,methyl hydroxyacetate,acetic acid, hydroxy-, methyl ester,glycolic acid, methyl ester,acetic acid, 2-hydroxy-, methyl ester,glycolic acid methyl ester,unii-7g7r729ej0,hydroxyacetic acid methyl ester,glycolic acid methyl,methyl2-hydroxyethanoate
Numéro MDL MFCD00004667
CAS 96-35-5
CID PubChem 66774
Nom IUPAC methyl 2-hydroxyacetate
Clé InChI GSJFXBNYJCXDGI-UHFFFAOYSA-N
SMILES COC(=O)CO
Formule moléculaire C3H6O3
6

Benzyl methacrylate, 98%, stab. with ca 50-100ppm 4-methoxyphenol

CAS: 2495-37-6 Formule moléculaire: C11H12O2 Poids moléculaire (g/mol): 176.215 Numéro MDL: MFCD00053684 Clé InChI: AOJOEFVRHOZDFN-UHFFFAOYSA-N Synonyme: benzyl methacrylate,2-propenoic acid, 2-methyl-, phenylmethyl ester,benzylmethacrylate,methacrylic acid benzyl ester,methacrylic acid, benzyl ester,unii-z3248k2ssm,phenylmethyl 2-methylprop-2-enoate,poly benzylmethacrylate,bzma,methacrylic acid benzyl CID PubChem: 17236 Nom IUPAC: benzyl 2-methylprop-2-enoate SMILES: CC(=C)C(=O)OCC1=CC=CC=C1

Poids moléculaire (g/mol) 176.215
Synonyme benzyl methacrylate,2-propenoic acid, 2-methyl-, phenylmethyl ester,benzylmethacrylate,methacrylic acid benzyl ester,methacrylic acid, benzyl ester,unii-z3248k2ssm,phenylmethyl 2-methylprop-2-enoate,poly benzylmethacrylate,bzma,methacrylic acid benzyl
Numéro MDL MFCD00053684
CAS 2495-37-6
CID PubChem 17236
Nom IUPAC benzyl 2-methylprop-2-enoate
Clé InChI AOJOEFVRHOZDFN-UHFFFAOYSA-N
SMILES CC(=C)C(=O)OCC1=CC=CC=C1
Formule moléculaire C11H12O2
7

Methyl 3-ethoxythiophene-2-carboxylate, 97%

CAS: 139926-22-0 Formule moléculaire: C8H10O3S Poids moléculaire (g/mol): 186.23 Numéro MDL: MFCD00102116 Clé InChI: JAGLXKOXARHKBR-UHFFFAOYSA-N Synonyme: maybridge1_003754,acmc-1c0r9,methyl-3-ethoxythiophene carboxylate,3-ethoxy-2-thiophenecarboxylic acid methyl ester,3-ethoxythiophene-2-carboxylic acid methyl ester,2,3-ethoxy-thiophene-2-carboxylic acid methyl ester,2-thiophenecarboxylicacid, 3-ethoxy-, methyl ester CID PubChem: 2777650 Nom IUPAC: methyl 3-ethoxythiophene-2-carboxylate SMILES: CCOC1=C(SC=C1)C(=O)OC

Poids moléculaire (g/mol) 186.23
Synonyme maybridge1_003754,acmc-1c0r9,methyl-3-ethoxythiophene carboxylate,3-ethoxy-2-thiophenecarboxylic acid methyl ester,3-ethoxythiophene-2-carboxylic acid methyl ester,2,3-ethoxy-thiophene-2-carboxylic acid methyl ester,2-thiophenecarboxylicacid, 3-ethoxy-, methyl ester
Numéro MDL MFCD00102116
CAS 139926-22-0
CID PubChem 2777650
Nom IUPAC methyl 3-ethoxythiophene-2-carboxylate
Clé InChI JAGLXKOXARHKBR-UHFFFAOYSA-N
SMILES CCOC1=C(SC=C1)C(=O)OC
Formule moléculaire C8H10O3S
8

Methyl p-toluate, 99%

CAS: 99-75-2 Formule moléculaire: C9H10O2 Poids moléculaire (g/mol): 150.177 Numéro MDL: MFCD00008441 Clé InChI: QSSJZLPUHJDYKF-UHFFFAOYSA-N Synonyme: methyl p-toluate,methyl-p-toluate,p-carbomethoxytoluene,methyl 4-toluate,4-methylbenzoic acid methyl ester,methyl p-methylbenzoate,benzoic acid, 4-methyl-, methyl ester,4-methoxycarbonyl toluene,p-toluic acid, methyl ester,methyl p-toluenecarboxylate CID PubChem: 7455 Nom IUPAC: methyl 4-methylbenzoate SMILES: CC1=CC=C(C=C1)C(=O)OC

Poids moléculaire (g/mol) 150.177
Synonyme methyl p-toluate,methyl-p-toluate,p-carbomethoxytoluene,methyl 4-toluate,4-methylbenzoic acid methyl ester,methyl p-methylbenzoate,benzoic acid, 4-methyl-, methyl ester,4-methoxycarbonyl toluene,p-toluic acid, methyl ester,methyl p-toluenecarboxylate
Numéro MDL MFCD00008441
CAS 99-75-2
CID PubChem 7455
Nom IUPAC methyl 4-methylbenzoate
Clé InChI QSSJZLPUHJDYKF-UHFFFAOYSA-N
SMILES CC1=CC=C(C=C1)C(=O)OC
Formule moléculaire C9H10O2
9

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
10

n-Butylidenephthalide, (E)+(Z), 95%

CAS: 551-08-6 Formule moléculaire: C12H12O2 Poids moléculaire (g/mol): 188.23 Numéro MDL: MFCD00047319,MFCD00047319 Clé InChI: WMBOCUXXNSOQHM-DHZHZOJOSA-N Synonyme: ligusticum lactone,butylidene phthalide,n-butylidene phthalide,3-butylidene-1 3h-isobenzofuranone,3-butylidenephthalide,phthalide, 3-butylidene,fema no. 3333,bdph,3-butylidene phthalide,1 3h-isobenzofuranone, 3-butylidene CID PubChem: 5352899 Nom IUPAC: (3E)-3-butylidene-2-benzofuran-1-one SMILES: CCC\C=C1\OC(=O)C2=CC=CC=C12

Poids moléculaire (g/mol) 188.23
Synonyme ligusticum lactone,butylidene phthalide,n-butylidene phthalide,3-butylidene-1 3h-isobenzofuranone,3-butylidenephthalide,phthalide, 3-butylidene,fema no. 3333,bdph,3-butylidene phthalide,1 3h-isobenzofuranone, 3-butylidene
Numéro MDL MFCD00047319,MFCD00047319
CAS 551-08-6
CID PubChem 5352899
Nom IUPAC (3E)-3-butylidene-2-benzofuran-1-one
Clé InChI WMBOCUXXNSOQHM-DHZHZOJOSA-N
SMILES CCC\C=C1\OC(=O)C2=CC=CC=C12
Formule moléculaire C12H12O2
11

Methyl tiglate, 98%

CAS: 6622-76-0 Formule moléculaire: C6H10O2 Poids moléculaire (g/mol): 114.14 Numéro MDL: MFCD00016654 Clé InChI: YYJWBYNQJLBIGS-PLNGDYQASA-N Synonyme: methyl tiglate,tiglic acid methyl ester,methyl 2-methylbut-2-enoate,methyl 2-methyl-2-butenoate,methyl e-2-methylcrotonate,methyl 2-methylcrotonate,methyl alpha-methylcrotonate,methyl trans-2-methylcrotonate,2-butenoic acid, 2-methyl-, methyl ester, e,crotonic acid, 2-methyl-, methyl ester, e CID PubChem: 5323652 Nom IUPAC: methyl (E)-2-methylbut-2-enoate SMILES: COC(=O)C(\C)=C/C

Poids moléculaire (g/mol) 114.14
Synonyme methyl tiglate,tiglic acid methyl ester,methyl 2-methylbut-2-enoate,methyl 2-methyl-2-butenoate,methyl e-2-methylcrotonate,methyl 2-methylcrotonate,methyl alpha-methylcrotonate,methyl trans-2-methylcrotonate,2-butenoic acid, 2-methyl-, methyl ester, e,crotonic acid, 2-methyl-, methyl ester, e
Numéro MDL MFCD00016654
CAS 6622-76-0
CID PubChem 5323652
Nom IUPAC methyl (E)-2-methylbut-2-enoate
Clé InChI YYJWBYNQJLBIGS-PLNGDYQASA-N
SMILES COC(=O)C(\C)=C/C
Formule moléculaire C6H10O2
12

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
13

Ethylene glycol dimethacrylate, 98%, stab. with 100ppm 4-methoxyphenol

CAS: 97-90-5 Formule moléculaire: C10H14O4 Poids moléculaire (g/mol): 198.22 Numéro MDL: MFCD00008590 Clé InChI: STVZJERGLQHEKB-UHFFFAOYSA-N Synonyme: ethylene glycol dimethacrylate,ethylene dimethacrylate,glycol dimethacrylate,diglycol dimethacrylate,ethanediol dimethacrylate,ethylenedimethyacrylate,ethylene methacrylate,ethyldiol metacrylate,1,2-bis methacryloyloxy ethane,ethylene glycol bis methacrylate CID PubChem: 7355 ChEBI: CHEBI:53436 Nom IUPAC: 2-(2-methylprop-2-enoyloxy)ethyl 2-methylprop-2-enoate SMILES: CC(=C)C(=O)OCCOC(=O)C(C)=C

Poids moléculaire (g/mol) 198.22
Synonyme ethylene glycol dimethacrylate,ethylene dimethacrylate,glycol dimethacrylate,diglycol dimethacrylate,ethanediol dimethacrylate,ethylenedimethyacrylate,ethylene methacrylate,ethyldiol metacrylate,1,2-bis methacryloyloxy ethane,ethylene glycol bis methacrylate
Numéro MDL MFCD00008590
CAS 97-90-5
CID PubChem 7355
ChEBI CHEBI:53436
Nom IUPAC 2-(2-methylprop-2-enoyloxy)ethyl 2-methylprop-2-enoate
Clé InChI STVZJERGLQHEKB-UHFFFAOYSA-N
SMILES CC(=C)C(=O)OCCOC(=O)C(C)=C
Formule moléculaire C10H14O4
14

Methyl coumalate, 98%

CAS: 6018-41-3 Formule moléculaire: C7H6O4 Poids moléculaire (g/mol): 154.121 Numéro MDL: MFCD00010120 Clé InChI: HHWWWZQYHPFCBY-UHFFFAOYSA-N Synonyme: methyl coumalate,methyl 2-oxo-2h-pyran-5-carboxylate,coumalic acid, methyl ester,5-carbomethoxy-2-pyrone,2h-pyran-5-carboxylic acid, 2-oxo-, methyl ester,coumalic acid methyl ester,unii-1s7tmf0r8t,methyl 2-pyrone-5-carboxylate,methyl 2-oxopyran-5-carboxylate,1s7tmf0r8t CID PubChem: 80113 Nom IUPAC: methyl 6-oxopyran-3-carboxylate SMILES: COC(=O)C1=COC(=O)C=C1

Poids moléculaire (g/mol) 154.121
Synonyme methyl coumalate,methyl 2-oxo-2h-pyran-5-carboxylate,coumalic acid, methyl ester,5-carbomethoxy-2-pyrone,2h-pyran-5-carboxylic acid, 2-oxo-, methyl ester,coumalic acid methyl ester,unii-1s7tmf0r8t,methyl 2-pyrone-5-carboxylate,methyl 2-oxopyran-5-carboxylate,1s7tmf0r8t
Numéro MDL MFCD00010120
CAS 6018-41-3
CID PubChem 80113
Nom IUPAC methyl 6-oxopyran-3-carboxylate
Clé InChI HHWWWZQYHPFCBY-UHFFFAOYSA-N
SMILES COC(=O)C1=COC(=O)C=C1
Formule moléculaire C7H6O4
15

Methyl 3,3-dimethoxypropionate, 96%

CAS: 7424-91-1 Formule moléculaire: C6H12O4 Poids moléculaire (g/mol): 148.158 Numéro MDL: MFCD00010650 Clé InChI: SMCVPMKCDDNUCQ-UHFFFAOYSA-N CID PubChem: 81924 Nom IUPAC: methyl 3,3-dimethoxypropanoate SMILES: COC(CC(=O)OC)OC

Poids moléculaire (g/mol) 148.158
Numéro MDL MFCD00010650
CAS 7424-91-1
CID PubChem 81924
Nom IUPAC methyl 3,3-dimethoxypropanoate
Clé InChI SMCVPMKCDDNUCQ-UHFFFAOYSA-N
SMILES COC(CC(=O)OC)OC
Formule moléculaire C6H12O4