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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Thermo Scientific Chemicals 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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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

n-Hexyl methacrylate, 97%, stab. with 100ppm 4-methoxyphenol

CAS: 142-09-6 Molecular Formula: C10H18O2 Molecular Weight (g/mol): 170.25 MDL Number: MFCD00015283 InChI Key: LNCPIMCVTKXXOY-UHFFFAOYSA-N Synonym: hexyl methacrylate,n-hexyl methacrylate,hexyl 2-methyl-2-propenoate,methacrylic acid, hexyl ester,2-propenoic acid, 2-methyl-, hexyl ester,unii-538b2q3hsv,ccris 4824,hexyl 2-methylacrylate,methacrylic acid hexyl ester,dsstox_cid_5406 PubChem CID: 8872 IUPAC Name: hexyl 2-methylprop-2-enoate SMILES: CCCCCCOC(=O)C(C)=C

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PubChem CID	8872
CAS	142-09-6
Molecular Weight (g/mol)	170.25
MDL Number	MFCD00015283
SMILES	CCCCCCOC(=O)C(C)=C
Synonym	hexyl methacrylate,n-hexyl methacrylate,hexyl 2-methyl-2-propenoate,methacrylic acid, hexyl ester,2-propenoic acid, 2-methyl-, hexyl ester,unii-538b2q3hsv,ccris 4824,hexyl 2-methylacrylate,methacrylic acid hexyl ester,dsstox_cid_5406
IUPAC Name	hexyl 2-methylprop-2-enoate
InChI Key	LNCPIMCVTKXXOY-UHFFFAOYSA-N
Molecular Formula	C10H18O2

Methyl benzoate, 99%

CAS: 93-58-3 Molecular Formula: C8H8O2 Molecular Weight (g/mol): 136.15 MDL Number: MFCD00008421 InChI Key: QPJVMBTYPHYUOC-UHFFFAOYSA-N Synonym: methylbenzoate,benzoic acid, methyl ester,clorius,benzoic acid methyl ester,niobe oil,oil of niobe,methyl benzenecarboxylate,essence of niobe,oniobe oil,oxidate le PubChem CID: 7150 ChEBI: CHEBI:72775 IUPAC Name: methyl benzoate SMILES: COC(=O)C1=CC=CC=C1

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PubChem CID	7150
CAS	93-58-3
Molecular Weight (g/mol)	136.15
ChEBI	CHEBI:72775
MDL Number	MFCD00008421
SMILES	COC(=O)C1=CC=CC=C1
Synonym	methylbenzoate,benzoic acid, methyl ester,clorius,benzoic acid methyl ester,niobe oil,oil of niobe,methyl benzenecarboxylate,essence of niobe,oniobe oil,oxidate le
IUPAC Name	methyl benzoate
InChI Key	QPJVMBTYPHYUOC-UHFFFAOYSA-N
Molecular Formula	C8H8O2

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 cinnamate, 98+%

CAS: 103-36-6 Molecular Formula: C11H12O2 Molecular Weight (g/mol): 176.215 MDL Number: MFCD00009189 InChI Key: KBEBGUQPQBELIU-CMDGGOBGSA-N Synonym: 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 PubChem CID: 637758 ChEBI: CHEBI:4895 IUPAC Name: ethyl (E)-3-phenylprop-2-enoate SMILES: CCOC(=O)C=CC1=CC=CC=C1

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Specifications

PubChem CID	637758
CAS	103-36-6
Molecular Weight (g/mol)	176.215
ChEBI	CHEBI:4895
MDL Number	MFCD00009189
SMILES	CCOC(=O)C=CC1=CC=CC=C1
Synonym	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
IUPAC Name	ethyl (E)-3-phenylprop-2-enoate
InChI Key	KBEBGUQPQBELIU-CMDGGOBGSA-N
Molecular Formula	C11H12O2

Dimethyl oxalate, 99%

CAS: 553-90-2 Molecular Formula: C4H6O4 Molecular Weight (g/mol): 118.09 MDL Number: MFCD00008442 InChI Key: LOMVENUNSWAXEN-UHFFFAOYSA-N Synonym: methyl oxalate,ethanedioic acid, dimethyl ester,oxalic acid dimethyl ester,dimethyloxalate,oxalic acid, dimethyl ester,dimethyl ethanedioate,unii-iq3q79344s,ethanedioic acid, 1,2-dimethyl ester,dimethyl ethane-1,2-dioate,dimethyl ester of oxalic acid PubChem CID: 11120 ChEBI: CHEBI:6859 IUPAC Name: dimethyl oxalate SMILES: COC(=O)C(=O)OC

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PubChem CID	11120
CAS	553-90-2
Molecular Weight (g/mol)	118.09
ChEBI	CHEBI:6859
MDL Number	MFCD00008442
SMILES	COC(=O)C(=O)OC
Synonym	methyl oxalate,ethanedioic acid, dimethyl ester,oxalic acid dimethyl ester,dimethyloxalate,oxalic acid, dimethyl ester,dimethyl ethanedioate,unii-iq3q79344s,ethanedioic acid, 1,2-dimethyl ester,dimethyl ethane-1,2-dioate,dimethyl ester of oxalic acid
IUPAC Name	dimethyl oxalate
InChI Key	LOMVENUNSWAXEN-UHFFFAOYSA-N
Molecular Formula	C4H6O4

Dimethyl fumarate, 99%

CAS: 624-49-7 Molecular Formula: C₆H₈O₄ Molecular Weight (g/mol): 144.13 MDL Number: MFCD00064438 InChI Key: LDCRTTXIJACKKU-ONEGZZNKSA-N Synonym: dimethyl fumarate,tecfidera,e-dimethyl fumarate,fumaderm,dimethyl e-but-2-enedioate,fumaric acid, dimethyl ester,boletic acid dimethyl ester,fumaric acid dimethyl ester,methyl fumarate,dimethyl trans-ethylenedicarboxylate PubChem CID: 637568 ChEBI: CHEBI:76004 IUPAC Name: dimethyl (E)-but-2-enedioate SMILES: COC(=O)C=CC(=O)OC

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PubChem CID	637568
CAS	624-49-7
Molecular Weight (g/mol)	144.13
ChEBI	CHEBI:76004
MDL Number	MFCD00064438
SMILES	COC(=O)C=CC(=O)OC
Synonym	dimethyl fumarate,tecfidera,e-dimethyl fumarate,fumaderm,dimethyl e-but-2-enedioate,fumaric acid, dimethyl ester,boletic acid dimethyl ester,fumaric acid dimethyl ester,methyl fumarate,dimethyl trans-ethylenedicarboxylate
IUPAC Name	dimethyl (E)-but-2-enedioate
InChI Key	LDCRTTXIJACKKU-ONEGZZNKSA-N
Molecular Formula	C₆H₈O₄

Ethylene dimethacrylate, 98%, stabilized

CAS: 97-90-5 Molecular Formula: C10H14O4 Molecular Weight (g/mol): 198.22 MDL Number: MFCD00008590 InChI Key: STVZJERGLQHEKB-UHFFFAOYSA-N Synonym: 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 PubChem CID: 7355 ChEBI: CHEBI:53436 SMILES: CC(=C)C(=O)OCCOC(=O)C(C)=C

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Specifications

PubChem CID	7355
CAS	97-90-5
Molecular Weight (g/mol)	198.22
ChEBI	CHEBI:53436
MDL Number	MFCD00008590
SMILES	CC(=C)C(=O)OCCOC(=O)C(C)=C
Synonym	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
InChI Key	STVZJERGLQHEKB-UHFFFAOYSA-N
Molecular Formula	C10H14O4

Dimethyl oxalate, 99%

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Specifications

PubChem CID	11120
CAS	553-90-2
Molecular Weight (g/mol)	118.09
ChEBI	CHEBI:6859
MDL Number	MFCD00008442
SMILES	COC(=O)C(=O)OC
Synonym	methyl oxalate,ethanedioic acid, dimethyl ester,oxalic acid dimethyl ester,dimethyloxalate,oxalic acid, dimethyl ester,dimethyl ethanedioate,unii-iq3q79344s,ethanedioic acid, 1,2-dimethyl ester,dimethyl ethane-1,2-dioate,dimethyl ester of oxalic acid
IUPAC Name	dimethyl oxalate
InChI Key	LOMVENUNSWAXEN-UHFFFAOYSA-N
Molecular Formula	C4H6O4

Methyl acetate, 99+%, Extra Dry, AcroSeal™

CAS: 79-20-9 Molecular Formula: C₃H₆O₂ Molecular Weight (g/mol): 74.08 MDL Number: MFCD00008711 InChI Key: KXKVLQRXCPHEJC-UHFFFAOYSA-N Synonym: tereton,devoton,acetic acid, methyl ester,methyl ethanoate,acetic acid methyl ester,methylacetat,acetate de methyle,methylacetaat,methyl acetic ester,octan metylu PubChem CID: 6584 ChEBI: CHEBI:77700 IUPAC Name: methyl acetate SMILES: CC(=O)OC

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Specifications

PubChem CID	6584
CAS	79-20-9
Molecular Weight (g/mol)	74.08
ChEBI	CHEBI:77700
MDL Number	MFCD00008711
SMILES	CC(=O)OC
Synonym	tereton,devoton,acetic acid, methyl ester,methyl ethanoate,acetic acid methyl ester,methylacetat,acetate de methyle,methylacetaat,methyl acetic ester,octan metylu
IUPAC Name	methyl acetate
InChI Key	KXKVLQRXCPHEJC-UHFFFAOYSA-N
Molecular Formula	C₃H₆O₂

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2-(Dimethylamino)ethyl methacrylate, 99%, stabilized

CAS: 2867-47-2 Molecular Formula: C₈H₁₅NO₂ Molecular Weight (g/mol): 157.21 MDL Number: MFCD00008589 InChI Key: JKNCOURZONDCGV-UHFFFAOYSA-N Synonym: 2-dimethylamino ethyl methacrylate,dimethylaminoethyl methacrylate,ageflex fm-1,dmaema,usaf rh-3,2-propenoic acid, 2-methyl-, 2-dimethylamino ethyl ester,2-n,n-dimethylamino ethyl methacrylate,n,n-dimethylaminoethyl methacrylate,2-dimethylaminoethyl methacrylate,n,n-dimethylethanolamine methacrylate PubChem CID: 17869 IUPAC Name: 2-(dimethylamino)ethyl 2-methylprop-2-enoate SMILES: CC(=C)C(=O)OCCN(C)C

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PubChem CID	17869
CAS	2867-47-2
Molecular Weight (g/mol)	157.21
MDL Number	MFCD00008589
SMILES	CC(=C)C(=O)OCCN(C)C
Synonym	2-dimethylamino ethyl methacrylate,dimethylaminoethyl methacrylate,ageflex fm-1,dmaema,usaf rh-3,2-propenoic acid, 2-methyl-, 2-dimethylamino ethyl ester,2-n,n-dimethylamino ethyl methacrylate,n,n-dimethylaminoethyl methacrylate,2-dimethylaminoethyl methacrylate,n,n-dimethylethanolamine methacrylate
IUPAC Name	2-(dimethylamino)ethyl 2-methylprop-2-enoate
InChI Key	JKNCOURZONDCGV-UHFFFAOYSA-N
Molecular Formula	C₈H₁₅NO₂

Methyl benzoate, 99%

CAS: 93-58-3 Molecular Formula: C₈H₈O₂ Molecular Weight (g/mol): 136.15 InChI Key: QPJVMBTYPHYUOC-UHFFFAOYSA-N Synonym: methylbenzoate,benzoic acid, methyl ester,clorius,benzoic acid methyl ester,niobe oil,oil of niobe,methyl benzenecarboxylate,essence of niobe,oniobe oil,oxidate le PubChem CID: 7150 ChEBI: CHEBI:72775 IUPAC Name: methyl benzoate SMILES: COC(=O)C1=CC=CC=C1

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Specifications

PubChem CID	7150
CAS	93-58-3
Molecular Weight (g/mol)	136.15
ChEBI	CHEBI:72775
SMILES	COC(=O)C1=CC=CC=C1
Synonym	methylbenzoate,benzoic acid, methyl ester,clorius,benzoic acid methyl ester,niobe oil,oil of niobe,methyl benzenecarboxylate,essence of niobe,oniobe oil,oxidate le
IUPAC Name	methyl benzoate
InChI Key	QPJVMBTYPHYUOC-UHFFFAOYSA-N
Molecular Formula	C₈H₈O₂

Methyl methacrylate, 99%, stabilized

CAS: 80-62-6 Molecular Formula: C₅H₈O₂ Molecular Weight (g/mol): 100.12 MDL Number: MFCD00008587 InChI Key: VVQNEPGJFQJSBK-UHFFFAOYSA-N Synonym: methyl methacrylate,methylmethacrylate,methacrylic acid methyl ester,methyl methylacrylate,methyl 2-methylpropenoate,pegalan,methyl-methacrylat,diakon,acryester m,methyl 2-methyl-2-propenoate PubChem CID: 6658 ChEBI: CHEBI:34840 IUPAC Name: methyl 2-methylprop-2-enoate SMILES: CC(=C)C(=O)OC

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PubChem CID	6658
CAS	80-62-6
Molecular Weight (g/mol)	100.12
ChEBI	CHEBI:34840
MDL Number	MFCD00008587
SMILES	CC(=C)C(=O)OC
Synonym	methyl methacrylate,methylmethacrylate,methacrylic acid methyl ester,methyl methylacrylate,methyl 2-methylpropenoate,pegalan,methyl-methacrylat,diakon,acryester m,methyl 2-methyl-2-propenoate
IUPAC Name	methyl 2-methylprop-2-enoate
InChI Key	VVQNEPGJFQJSBK-UHFFFAOYSA-N
Molecular Formula	C₅H₈O₂

Methyl methacrylate, 99%, stab.

CAS: 80-62-6 Molecular Formula: C5H8O2 MDL Number: MFCD00008587 InChI Key: VVQNEPGJFQJSBK-UHFFFAOYSA-N Synonym: methyl methacrylate,methylmethacrylate,methacrylic acid methyl ester,methyl methylacrylate,methyl 2-methylpropenoate,pegalan,methyl-methacrylat,diakon,acryester m,methyl 2-methyl-2-propenoate PubChem CID: 6658 ChEBI: CHEBI:34840 IUPAC Name: methyl 2-methylprop-2-enoate

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Specifications

PubChem CID	6658
CAS	80-62-6
ChEBI	CHEBI:34840
MDL Number	MFCD00008587
Synonym	methyl methacrylate,methylmethacrylate,methacrylic acid methyl ester,methyl methylacrylate,methyl 2-methylpropenoate,pegalan,methyl-methacrylat,diakon,acryester m,methyl 2-methyl-2-propenoate
IUPAC Name	methyl 2-methylprop-2-enoate
InChI Key	VVQNEPGJFQJSBK-UHFFFAOYSA-N
Molecular Formula	C5H8O2

Methyl chloroacetate, 99+%

CAS: 96-34-4 Molecular Formula: C3H5ClO2 Molecular Weight (g/mol): 108.521 MDL Number: MFCD00000931 InChI Key: QABLOFMHHSOFRJ-UHFFFAOYSA-N Synonym: methyl chloroacetate,chloroacetic acid methyl ester,methyl monochloroacetate,methyl chloroethanoate,acetic acid, chloro-, methyl ester,methyl monochloracetate,methyl alpha-chloroacetate,methylchloroacetate,unii-450vsb182i,ccris 7749 PubChem CID: 7295 IUPAC Name: methyl 2-chloroacetate SMILES: COC(=O)CCl

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PubChem CID	7295
CAS	96-34-4
Molecular Weight (g/mol)	108.521
MDL Number	MFCD00000931
SMILES	COC(=O)CCl
Synonym	methyl chloroacetate,chloroacetic acid methyl ester,methyl monochloroacetate,methyl chloroethanoate,acetic acid, chloro-, methyl ester,methyl monochloracetate,methyl alpha-chloroacetate,methylchloroacetate,unii-450vsb182i,ccris 7749
IUPAC Name	methyl 2-chloroacetate
InChI Key	QABLOFMHHSOFRJ-UHFFFAOYSA-N
Molecular Formula	C3H5ClO2

Carboxylic acid esters

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