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.

1 – 15 of 1,251 results

Methyl 3-bromopropionate, 97%

CAS: 3395-91-3 Molecular Formula: C4H7BrO2 Molecular Weight (g/mol): 167.00 MDL Number: MFCD00000250 InChI Key: KQEVIFKPZOGBMZ-UHFFFAOYSA-N Synonym: methyl 3-bromopropionate,propanoic acid, 3-bromo-, methyl ester,methyl beta-bromopropionate,3-bromopropionic acid methyl ester,propionic acid, 3-bromo-, methyl ester,3-bromopropanoic acid methyl ester,unii-y803ch1p4w,beta-bromopropionic acid, methyl ester,methyl .beta.-bromopropionate,3-bromo-propionic acid methyl ester PubChem CID: 76934 IUPAC Name: methyl 3-bromopropanoate SMILES: COC(=O)CCBr

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PubChem CID	76934
CAS	3395-91-3
Molecular Weight (g/mol)	167.00
MDL Number	MFCD00000250
SMILES	COC(=O)CCBr
Synonym	methyl 3-bromopropionate,propanoic acid, 3-bromo-, methyl ester,methyl beta-bromopropionate,3-bromopropionic acid methyl ester,propionic acid, 3-bromo-, methyl ester,3-bromopropanoic acid methyl ester,unii-y803ch1p4w,beta-bromopropionic acid, methyl ester,methyl .beta.-bromopropionate,3-bromo-propionic acid methyl ester
IUPAC Name	methyl 3-bromopropanoate
InChI Key	KQEVIFKPZOGBMZ-UHFFFAOYSA-N
Molecular Formula	C4H7BrO2

Methyl cyanoacetate, 97%

CAS: 105-34-0 Molecular Formula: C4H5NO2 Molecular Weight (g/mol): 99.09 MDL Number: MFCD00001939 InChI Key: ANGDWNBGPBMQHW-UHFFFAOYSA-N Synonym: methyl cyanoacetate,cyanoacetic acid methyl ester,methyl cyanoethanoate,acetic acid, cyano-, methyl ester,usaf kf-22,methylester kyseliny kyanoctove,methylcyanoacetate,malonic methyl ester nitrile,acetic acid, 2-cyano-, methyl ester,methyl cyano acetate PubChem CID: 7747 ChEBI: CHEBI:51928 IUPAC Name: methyl 2-cyanoacetate SMILES: COC(=O)CC#N

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Specifications

PubChem CID	7747
CAS	105-34-0
Molecular Weight (g/mol)	99.09
ChEBI	CHEBI:51928
MDL Number	MFCD00001939
SMILES	COC(=O)CC#N
Synonym	methyl cyanoacetate,cyanoacetic acid methyl ester,methyl cyanoethanoate,acetic acid, cyano-, methyl ester,usaf kf-22,methylester kyseliny kyanoctove,methylcyanoacetate,malonic methyl ester nitrile,acetic acid, 2-cyano-, methyl ester,methyl cyano acetate
IUPAC Name	methyl 2-cyanoacetate
InChI Key	ANGDWNBGPBMQHW-UHFFFAOYSA-N
Molecular Formula	C4H5NO2

Methyl 6-chloropyridazine-4-carboxylate, 97%

CAS: 1093860-48-0 Molecular Formula: C6H5ClN2O2 Molecular Weight (g/mol): 172.57 MDL Number: MFCD16660968 InChI Key: QYQHGLKSLGUINZ-UHFFFAOYSA-N Synonym: 6-chloro-pyridazine-4-carboxylic acid methyl ester,methyl6-chloropyridazine-4-carboxylate,4-pyridazinecarboxylicacid, 6-chloro-, methyl ester,6-chloro-4-pyridazinecarboxylic acid, methyl ester,4-pyridazinecarboxylic acid, 6-chloro-, methyl ester PubChem CID: 45790080 IUPAC Name: methyl 6-chloropyridazine-4-carboxylate SMILES: COC(=O)C1=CC(Cl)=NN=C1

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Specifications

PubChem CID	45790080
CAS	1093860-48-0
Molecular Weight (g/mol)	172.57
MDL Number	MFCD16660968
SMILES	COC(=O)C1=CC(Cl)=NN=C1
Synonym	6-chloro-pyridazine-4-carboxylic acid methyl ester,methyl6-chloropyridazine-4-carboxylate,4-pyridazinecarboxylicacid, 6-chloro-, methyl ester,6-chloro-4-pyridazinecarboxylic acid, methyl ester,4-pyridazinecarboxylic acid, 6-chloro-, methyl ester
IUPAC Name	methyl 6-chloropyridazine-4-carboxylate
InChI Key	QYQHGLKSLGUINZ-UHFFFAOYSA-N
Molecular Formula	C6H5ClN2O2

Dimethyl maleate, 96%

CAS: 624-48-6 Molecular Formula: C₆H₈O₄ Molecular Weight (g/mol): 144.13 MDL Number: MFCD00008459 InChI Key: LDCRTTXIJACKKU-ARJAWSKDSA-N Synonym: 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 PubChem CID: 5271565 ChEBI: CHEBI:35460 IUPAC Name: dimethyl (Z)-but-2-enedioate SMILES: COC(=O)C=CC(=O)OC

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Specifications

PubChem CID	5271565
CAS	624-48-6
Molecular Weight (g/mol)	144.13
ChEBI	CHEBI:35460
MDL Number	MFCD00008459
SMILES	COC(=O)C=CC(=O)OC
Synonym	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
IUPAC Name	dimethyl (Z)-but-2-enedioate
InChI Key	LDCRTTXIJACKKU-ARJAWSKDSA-N
Molecular Formula	C₆H₈O₄

Methyl methoxyacetate, 99%

CAS: 6290-49-9 Molecular Formula: C4H8O3 Molecular Weight (g/mol): 104.11 MDL Number: MFCD00008451 InChI Key: QRMHDGWGLNLHMN-UHFFFAOYSA-N Synonym: methyl methoxyacetate,acetic acid, methoxy-, methyl ester,methoxyacetic acid methyl ester,methyl-2-methoxyacetate,methoxyacetic acid, methyl ester,acetic acid, 2-methoxy-, methyl ester,unii-n960nq69lf,methoxy acetic acid methyl ester,methyl metoxyacetate,methyl methoxylacetate PubChem CID: 80507 ChEBI: CHEBI:34841 IUPAC Name: methyl 2-methoxyacetate SMILES: COCC(=O)OC

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Specifications

PubChem CID	80507
CAS	6290-49-9
Molecular Weight (g/mol)	104.11
ChEBI	CHEBI:34841
MDL Number	MFCD00008451
SMILES	COCC(=O)OC
Synonym	methyl methoxyacetate,acetic acid, methoxy-, methyl ester,methoxyacetic acid methyl ester,methyl-2-methoxyacetate,methoxyacetic acid, methyl ester,acetic acid, 2-methoxy-, methyl ester,unii-n960nq69lf,methoxy acetic acid methyl ester,methyl metoxyacetate,methyl methoxylacetate
IUPAC Name	methyl 2-methoxyacetate
InChI Key	QRMHDGWGLNLHMN-UHFFFAOYSA-N
Molecular Formula	C4H8O3

L-Ascorbic acid sodium salt, 99%

CAS: 134-03-2 Molecular Formula: C6H7NaO6 Molecular Weight (g/mol): 198.11 MDL Number: MFCD00082340 InChI Key: IFVCRSPJFHGFCG-HXPAKLQESA-N Synonym: sodium ascorbate,l-ascorbic acid sodium salt,sodium l-ascorbate,vitamin c sodium,ascorbicin,sodascorbate,cebitate,aminofenitrooxon,natrii ascorbas,monosodium l-ascorbate PubChem CID: 131674100 IUPAC Name: 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

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Specifications

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

Ethyl 4-bromocrotonate, 75%, tech.

CAS: 37746-78-4 Molecular Formula: C₆H₉BrO₂ Molecular Weight (g/mol): 193.04 MDL Number: MFCD00000247 InChI Key: FHGRPBSDPBRTLS-ONEGZZNKSA-N Synonym: ethyl 4-bromocrotonate,e-ethyl 4-bromobut-2-enoate,ethyl 4-bromobut-2-enoate,4-bromocrotonic acid ethyl ester,ethyl 2e-4-bromobut-2-enoate,2-butenoic acid, 4-bromo-, ethyl ester, e,2-butenoic acid, 4-bromo-, ethyl ester,ethyl e-4-bromo-2-butenoate,ethyl e-4-bromobut-2-enoate,ethyl trans-4-bromo-2-butenoate PubChem CID: 5373944 IUPAC Name: ethyl (E)-4-bromobut-2-enoate SMILES: CCOC(=O)C=CCBr

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Specifications

PubChem CID	5373944
CAS	37746-78-4
Molecular Weight (g/mol)	193.04
MDL Number	MFCD00000247
SMILES	CCOC(=O)C=CCBr
Synonym	ethyl 4-bromocrotonate,e-ethyl 4-bromobut-2-enoate,ethyl 4-bromobut-2-enoate,4-bromocrotonic acid ethyl ester,ethyl 2e-4-bromobut-2-enoate,2-butenoic acid, 4-bromo-, ethyl ester, e,2-butenoic acid, 4-bromo-, ethyl ester,ethyl e-4-bromo-2-butenoate,ethyl e-4-bromobut-2-enoate,ethyl trans-4-bromo-2-butenoate
IUPAC Name	ethyl (E)-4-bromobut-2-enoate
InChI Key	FHGRPBSDPBRTLS-ONEGZZNKSA-N
Molecular Formula	C₆H₉BrO₂

Methyl 3,4-dichlorophenylacetate, 99%, Thermo Scientific™

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Ethyl cyclohexylideneacetate, 98%

CAS: 1552-92-7 Molecular Formula: C10H16O2 Molecular Weight (g/mol): 168.24 MDL Number: MFCD00017627,MFCD00963857 InChI Key: MCWDXHYYYNGYGK-UHFFFAOYSA-N Synonym: ethyl cyclohexylideneacetate,acetic acid, cyclohexylidene-, ethyl ester,ethyl 2-cyclohexylidenacetate,cyclohexylideneacetic acid ethyl ester,ethoxycarbonylmethylenecyclohexane,.delta.1,.alpha.-cyclohexaneacetic acid, ethyl ester,acmc-20ahxr,ethylcyclohexylidenacetate,.delta.1, ethyl ester,ethyl2-cyclohexylideneacetate PubChem CID: 73776 IUPAC Name: ethyl 2-cyclohexylideneacetate SMILES: CCOC(=O)C=C1CCCCC1

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Specifications

PubChem CID	73776
CAS	1552-92-7
Molecular Weight (g/mol)	168.24
MDL Number	MFCD00017627,MFCD00963857
SMILES	CCOC(=O)C=C1CCCCC1
Synonym	ethyl cyclohexylideneacetate,acetic acid, cyclohexylidene-, ethyl ester,ethyl 2-cyclohexylidenacetate,cyclohexylideneacetic acid ethyl ester,ethoxycarbonylmethylenecyclohexane,.delta.1,.alpha.-cyclohexaneacetic acid, ethyl ester,acmc-20ahxr,ethylcyclohexylidenacetate,.delta.1, ethyl ester,ethyl2-cyclohexylideneacetate
IUPAC Name	ethyl 2-cyclohexylideneacetate
InChI Key	MCWDXHYYYNGYGK-UHFFFAOYSA-N
Molecular Formula	C10H16O2

Thermo Scientific Chemicals Cefditoren pivoxyl

CAS: 117467-28-4 Molecular Formula: C25H28N6O7S3 Molecular Weight (g/mol): 620.71 MDL Number: MFCD00933166 InChI Key: AFZFFLVORLEPPO-UHFFFAOYNA-N IUPAC Name: {7-[2-(2-amino-1,3-thiazol-4-yl)-2-(methoxyimino)acetamido]-3-[2-(4-methyl-1,3-thiazol-5-yl)ethenyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carbonyloxy}methyl 2,2-dimethylpropanoate SMILES: CON=C(C(=O)NC1C2SCC(C=CC3=C(C)N=CS3)=C(N2C1=O)C(=O)OCOC(=O)C(C)(C)C)C1=CSC(N)=N1

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Specifications

CAS	117467-28-4
Molecular Weight (g/mol)	620.71
MDL Number	MFCD00933166
SMILES	CON=C(C(=O)NC1C2SCC(C=CC3=C(C)N=CS3)=C(N2C1=O)C(=O)OCOC(=O)C(C)(C)C)C1=CSC(N)=N1
IUPAC Name	{7-[2-(2-amino-1,3-thiazol-4-yl)-2-(methoxyimino)acetamido]-3-[2-(4-methyl-1,3-thiazol-5-yl)ethenyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carbonyloxy}methyl 2,2-dimethylpropanoate
InChI Key	AFZFFLVORLEPPO-UHFFFAOYNA-N
Molecular Formula	C25H28N6O7S3

tert-Butyl propiolate, 98%

CAS: 13831-03-3 Molecular Formula: C7H10O2 Molecular Weight (g/mol): 126.16 MDL Number: MFCD00060100 InChI Key: XGTPDIIFEPTULX-UHFFFAOYSA-N Synonym: tert-butyl propiolate,propiolic acid tert-butyl ester,t-butyl propiolate,2-propynoic acid, 1,1-dimethylethyl ester,boc-acetylene,tert-butyl propalate,tert-butyl propargylate,acmc-209chj,tert-butyl propiolate # PubChem CID: 543038 IUPAC Name: tert-butyl prop-2-ynoate SMILES: CC(C)(C)OC(=O)C#C

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Specifications

PubChem CID	543038
CAS	13831-03-3
Molecular Weight (g/mol)	126.16
MDL Number	MFCD00060100
SMILES	CC(C)(C)OC(=O)C#C
Synonym	tert-butyl propiolate,propiolic acid tert-butyl ester,t-butyl propiolate,2-propynoic acid, 1,1-dimethylethyl ester,boc-acetylene,tert-butyl propalate,tert-butyl propargylate,acmc-209chj,tert-butyl propiolate #
IUPAC Name	tert-butyl prop-2-ynoate
InChI Key	XGTPDIIFEPTULX-UHFFFAOYSA-N
Molecular Formula	C7H10O2

Ethyl indole-3-acrylate, 97%

CAS: 15181-86-9 Molecular Formula: C13H13NO2 Molecular Weight (g/mol): 215.252 MDL Number: MFCD00051947 InChI Key: OQJSITNIWIYWPU-FPLPWBNLSA-N Synonym: ethyl 2z-3-1h-indol-3-yl prop-2-enoate PubChem CID: 13863197 IUPAC Name: ethyl (Z)-3-(1H-indol-3-yl)prop-2-enoate SMILES: CCOC(=O)C=CC1=CNC2=CC=CC=C21

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Specifications

PubChem CID	13863197
CAS	15181-86-9
Molecular Weight (g/mol)	215.252
MDL Number	MFCD00051947
SMILES	CCOC(=O)C=CC1=CNC2=CC=CC=C21
Synonym	ethyl 2z-3-1h-indol-3-yl prop-2-enoate
IUPAC Name	ethyl (Z)-3-(1H-indol-3-yl)prop-2-enoate
InChI Key	OQJSITNIWIYWPU-FPLPWBNLSA-N
Molecular Formula	C13H13NO2

(R)-2-Isopropylsuccinic acid-1-methyl ester, 95%, (98% ee), Thermo Scientific Chemicals

CAS: 220498-08-8 Molecular Formula: C₈H₁₄O₄ Molecular Weight (g/mol): 174.19 MDL Number: MFCD01091030 InChI Key: VHOGSWBAPDPWTG-ZCFIWIBFSA-N Synonym: r-3-methoxycarbonyl-4-methylpentanoic acid,r-2-isopropyl-succinic acid-1-methyl ester,r-2-isopropylsuccinic acid-1-methyl ester,3r-3-methoxycarbonyl-4-methylpentanoic acid,2r-2-isopropylsuccinic acid 1-methyl ester,r---2-isopropylsuccinic acid 1-methyl ester,butanedioic acid,2-1-methylethyl-, 1-methyl ester, 2r PubChem CID: 5702634 IUPAC Name: (3R)-3-methoxycarbonyl-4-methylpentanoic acid SMILES: CC(C)C(CC(=O)O)C(=O)OC

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Specifications

PubChem CID	5702634
CAS	220498-08-8
Molecular Weight (g/mol)	174.19
MDL Number	MFCD01091030
SMILES	CC(C)C(CC(=O)O)C(=O)OC
Synonym	r-3-methoxycarbonyl-4-methylpentanoic acid,r-2-isopropyl-succinic acid-1-methyl ester,r-2-isopropylsuccinic acid-1-methyl ester,3r-3-methoxycarbonyl-4-methylpentanoic acid,2r-2-isopropylsuccinic acid 1-methyl ester,r---2-isopropylsuccinic acid 1-methyl ester,butanedioic acid,2-1-methylethyl-, 1-methyl ester, 2r
IUPAC Name	(3R)-3-methoxycarbonyl-4-methylpentanoic acid
InChI Key	VHOGSWBAPDPWTG-ZCFIWIBFSA-N
Molecular Formula	C₈H₁₄O₄

Methyl (S)-(-)-lactate, 97%

CAS: 27871-49-4 Molecular Formula: C4H8O3 Molecular Weight (g/mol): 104.11 MDL Number: MFCD00064265 InChI Key: LPEKGGXMPWTOCB-VKHMYHEASA-N Synonym: methyl s---lactate,methyl l-lactate,s-methyl lactate,--methyl l-lactate,s-lactic acid methyl ester,methyl 2s-2-hydroxypropanoate,--methyl lactate,methyl s-2-hydroxypropionate,propanoic acid, 2-hydroxy-, methyl ester, 2s,--lactic acid methyl ester PubChem CID: 94386 ChEBI: CHEBI:83222 IUPAC Name: methyl (2S)-2-hydroxypropanoate SMILES: COC(=O)[C@H](C)O

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Specifications

PubChem CID	94386
CAS	27871-49-4
Molecular Weight (g/mol)	104.11
ChEBI	CHEBI:83222
MDL Number	MFCD00064265
SMILES	COC(=O)[C@H](C)O
Synonym	methyl s---lactate,methyl l-lactate,s-methyl lactate,--methyl l-lactate,s-lactic acid methyl ester,methyl 2s-2-hydroxypropanoate,--methyl lactate,methyl s-2-hydroxypropionate,propanoic acid, 2-hydroxy-, methyl ester, 2s,--lactic acid methyl ester
IUPAC Name	methyl (2S)-2-hydroxypropanoate
InChI Key	LPEKGGXMPWTOCB-VKHMYHEASA-N
Molecular Formula	C4H8O3

Methyl tiglate, 98%

CAS: 6622-76-0 Molecular Formula: C6H10O2 Molecular Weight (g/mol): 114.14 MDL Number: MFCD00016654 InChI Key: YYJWBYNQJLBIGS-PLNGDYQASA-N Synonym: 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 PubChem CID: 5323652 IUPAC Name: methyl (E)-2-methylbut-2-enoate SMILES: COC(=O)C(\C)=C/C

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Specifications

PubChem CID	5323652
CAS	6622-76-0
Molecular Weight (g/mol)	114.14
MDL Number	MFCD00016654
SMILES	COC(=O)C(\C)=C/C
Synonym	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
IUPAC Name	methyl (E)-2-methylbut-2-enoate
InChI Key	YYJWBYNQJLBIGS-PLNGDYQASA-N
Molecular Formula	C6H10O2

Carboxylic acid esters

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