Carboxylic acids and derivatives
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1-Penten-3-yl Acetate 97.0+%, TCI America™
CAS: 10500-11-5 Molecular Formula: C7H12O2 Molecular Weight (g/mol): 128.171 MDL Number: MFCD02093427 InChI Key: MRLKTTBPWZXARX-UHFFFAOYSA-N Synonym: Acetic Acid 1-Ethylallyl Ester, Acetic Acid 1-Penten-3-yl Ester, 1-Ethylallyl Acetate PubChem CID: 530323 IUPAC Name: pent-1-en-3-yl acetate SMILES: CCC(C=C)OC(=O)C
| PubChem CID | 530323 |
|---|---|
| CAS | 10500-11-5 |
| Molecular Weight (g/mol) | 128.171 |
| MDL Number | MFCD02093427 |
| SMILES | CCC(C=C)OC(=O)C |
| Synonym | Acetic Acid 1-Ethylallyl Ester, Acetic Acid 1-Penten-3-yl Ester, 1-Ethylallyl Acetate |
| IUPAC Name | pent-1-en-3-yl acetate |
| InChI Key | MRLKTTBPWZXARX-UHFFFAOYSA-N |
| Molecular Formula | C7H12O2 |
Ethyl Phenylcyanoacetate 95.0+%, TCI America™
CAS: 4553-07-5 Molecular Formula: C11H11NO2 Molecular Weight (g/mol): 189.21 MDL Number: MFCD00001866 InChI Key: SXIRJEDGTAKGKU-UHFFFAOYNA-N Synonym: ethyl phenylcyanoacetate,phenylcyanoacetic acid ethyl ester,ethyl cyanophenylacetate,ethyl cyano phenyl acetate,ethyl alpha-cyanophenylacetate,ethyl alpha-cyano-alpha-phenylacetate,acetic acid, cyanophenyl-, ethyl ester,alpha-cyanobenzeneacetic acid, ethyl ester,benzeneacetic acid, alpha-cyano-, ethyl ester,benzeneacetic acid, .alpha.-cyano-, ethyl ester PubChem CID: 95298 ChEBI: CHEBI:51926 IUPAC Name: ethyl 2-cyano-2-phenylacetate SMILES: CCOC(=O)C(C#N)C1=CC=CC=C1
| PubChem CID | 95298 |
|---|---|
| CAS | 4553-07-5 |
| Molecular Weight (g/mol) | 189.21 |
| ChEBI | CHEBI:51926 |
| MDL Number | MFCD00001866 |
| SMILES | CCOC(=O)C(C#N)C1=CC=CC=C1 |
| Synonym | ethyl phenylcyanoacetate,phenylcyanoacetic acid ethyl ester,ethyl cyanophenylacetate,ethyl cyano phenyl acetate,ethyl alpha-cyanophenylacetate,ethyl alpha-cyano-alpha-phenylacetate,acetic acid, cyanophenyl-, ethyl ester,alpha-cyanobenzeneacetic acid, ethyl ester,benzeneacetic acid, alpha-cyano-, ethyl ester,benzeneacetic acid, .alpha.-cyano-, ethyl ester |
| IUPAC Name | ethyl 2-cyano-2-phenylacetate |
| InChI Key | SXIRJEDGTAKGKU-UHFFFAOYNA-N |
| Molecular Formula | C11H11NO2 |
2,2-Dimethylvaleric Acid 98.0+%, TCI America™
CAS: 1185-39-3 Molecular Formula: C7H14O2 Molecular Weight (g/mol): 130.187 MDL Number: MFCD00021686 InChI Key: ZRYCZAWRXHAAPZ-UHFFFAOYSA-N Synonym: 2,2-Dimethylpentanoic Acid PubChem CID: 14455 IUPAC Name: 2,2-dimethylpentanoic acid SMILES: CCCC(C)(C)C(=O)O
| PubChem CID | 14455 |
|---|---|
| CAS | 1185-39-3 |
| Molecular Weight (g/mol) | 130.187 |
| MDL Number | MFCD00021686 |
| SMILES | CCCC(C)(C)C(=O)O |
| Synonym | 2,2-Dimethylpentanoic Acid |
| IUPAC Name | 2,2-dimethylpentanoic acid |
| InChI Key | ZRYCZAWRXHAAPZ-UHFFFAOYSA-N |
| Molecular Formula | C7H14O2 |
2-Methyl-2-propenyl Acetate 98.0+%, TCI America™
CAS: 820-71-3 Molecular Formula: C6H10O2 Molecular Weight (g/mol): 114.144 MDL Number: MFCD00048215 InChI Key: IVKYUXHYUAMPMT-UHFFFAOYSA-N Synonym: methallyl acetate,2-methylallyl acetate,2-methylprop-2-en-1-yl acetate,2-propen-1-ol, 2-methyl-, acetate,2-methyl-2-propenyl acetate,beta-methallyl acetate,acmc-209pmw,.beta.-methallyl acetate,1-acetoxy-2-methyl-2-propene,acetic acid, 2-methylallylester PubChem CID: 69962 IUPAC Name: 2-methylprop-2-enyl acetate SMILES: CC(=C)COC(=O)C
| PubChem CID | 69962 |
|---|---|
| CAS | 820-71-3 |
| Molecular Weight (g/mol) | 114.144 |
| MDL Number | MFCD00048215 |
| SMILES | CC(=C)COC(=O)C |
| Synonym | methallyl acetate,2-methylallyl acetate,2-methylprop-2-en-1-yl acetate,2-propen-1-ol, 2-methyl-, acetate,2-methyl-2-propenyl acetate,beta-methallyl acetate,acmc-209pmw,.beta.-methallyl acetate,1-acetoxy-2-methyl-2-propene,acetic acid, 2-methylallylester |
| IUPAC Name | 2-methylprop-2-enyl acetate |
| InChI Key | IVKYUXHYUAMPMT-UHFFFAOYSA-N |
| Molecular Formula | C6H10O2 |
Ethyl Isovalerate 99.0+%, TCI America™
CAS: 108-64-5 Molecular Formula: C7H14O2 Molecular Weight (g/mol): 130.187 MDL Number: MFCD00009203 InChI Key: PPXUHEORWJQRHJ-UHFFFAOYSA-N Synonym: ethyl isovalerate,ethyl 3-methylbutyrate,ethylisovalerate,ethyl isopentanoate,isovaleric acid, ethyl ester,butanoic acid, 3-methyl-, ethyl ester,ethyl beta-methylbutyrate,ethyl isovalerianate,3-methylbutyric acid ethyl ester,3-methylbutanoic acid ethyl ester PubChem CID: 7945 ChEBI: CHEBI:31571 IUPAC Name: ethyl 3-methylbutanoate SMILES: CCOC(=O)CC(C)C
| PubChem CID | 7945 |
|---|---|
| CAS | 108-64-5 |
| Molecular Weight (g/mol) | 130.187 |
| ChEBI | CHEBI:31571 |
| MDL Number | MFCD00009203 |
| SMILES | CCOC(=O)CC(C)C |
| Synonym | ethyl isovalerate,ethyl 3-methylbutyrate,ethylisovalerate,ethyl isopentanoate,isovaleric acid, ethyl ester,butanoic acid, 3-methyl-, ethyl ester,ethyl beta-methylbutyrate,ethyl isovalerianate,3-methylbutyric acid ethyl ester,3-methylbutanoic acid ethyl ester |
| IUPAC Name | ethyl 3-methylbutanoate |
| InChI Key | PPXUHEORWJQRHJ-UHFFFAOYSA-N |
| Molecular Formula | C7H14O2 |
[(tert-Butoxycarbonyl)aminooxy]acetic Acid 98.0+%, TCI America™
CAS: 42989-85-5 Molecular Formula: C7H13NO5 Molecular Weight (g/mol): 191.183 MDL Number: MFCD01632027 InChI Key: QBXODCKYUZNZCY-UHFFFAOYSA-N Synonym: boc-aminooxy acetic acid,2-tert-butoxycarbonyl amino oxy acetic acid,boc-aoa-oh,boc-aminooxyacetic acid,boc-aoac-oh,n-boc-carboxymethoxy amine,boc-aminooxy aceticacid,2-tert-butoxy carbonyl amino oxy acetic acid,2-2-methylpropan-2-yl oxycarbonylamino oxyacetic acid,tert-butoxycarbonyl aminooxy acetic acid PubChem CID: 2755974 IUPAC Name: 2-[(2-methylpropan-2-yl)oxycarbonylamino]oxyacetic acid SMILES: CC(C)(C)OC(=O)NOCC(=O)O
| PubChem CID | 2755974 |
|---|---|
| CAS | 42989-85-5 |
| Molecular Weight (g/mol) | 191.183 |
| MDL Number | MFCD01632027 |
| SMILES | CC(C)(C)OC(=O)NOCC(=O)O |
| Synonym | boc-aminooxy acetic acid,2-tert-butoxycarbonyl amino oxy acetic acid,boc-aoa-oh,boc-aminooxyacetic acid,boc-aoac-oh,n-boc-carboxymethoxy amine,boc-aminooxy aceticacid,2-tert-butoxy carbonyl amino oxy acetic acid,2-2-methylpropan-2-yl oxycarbonylamino oxyacetic acid,tert-butoxycarbonyl aminooxy acetic acid |
| IUPAC Name | 2-[(2-methylpropan-2-yl)oxycarbonylamino]oxyacetic acid |
| InChI Key | QBXODCKYUZNZCY-UHFFFAOYSA-N |
| Molecular Formula | C7H13NO5 |
Butyl Decanoate 98.0+%, TCI America™
CAS: 30673-36-0 Molecular Formula: C14H28O2 Molecular Weight (g/mol): 228.376 MDL Number: MFCD00053823 InChI Key: ZRNCNTSXSYXHOW-UHFFFAOYSA-N Synonym: Decanoic Acid Butyl Ester PubChem CID: 35408 IUPAC Name: butyl decanoate SMILES: CCCCCCCCCC(=O)OCCCC
| PubChem CID | 35408 |
|---|---|
| CAS | 30673-36-0 |
| Molecular Weight (g/mol) | 228.376 |
| MDL Number | MFCD00053823 |
| SMILES | CCCCCCCCCC(=O)OCCCC |
| Synonym | Decanoic Acid Butyl Ester |
| IUPAC Name | butyl decanoate |
| InChI Key | ZRNCNTSXSYXHOW-UHFFFAOYSA-N |
| Molecular Formula | C14H28O2 |
Isoamyl Lactate 98.0+%, TCI America™
CAS: 19329-89-6 Molecular Formula: C8H16O3 Molecular Weight (g/mol): 160.213 MDL Number: MFCD00046638 InChI Key: CRORGGSWAKIXSA-UHFFFAOYSA-N Synonym: Lactic Acid Isoamyl Ester, Isopentyl Lactate PubChem CID: 86851 ChEBI: CHEBI:87534 IUPAC Name: 3-methylbutyl 2-hydroxypropanoate SMILES: CC(C)CCOC(=O)C(C)O
| PubChem CID | 86851 |
|---|---|
| CAS | 19329-89-6 |
| Molecular Weight (g/mol) | 160.213 |
| ChEBI | CHEBI:87534 |
| MDL Number | MFCD00046638 |
| SMILES | CC(C)CCOC(=O)C(C)O |
| Synonym | Lactic Acid Isoamyl Ester, Isopentyl Lactate |
| IUPAC Name | 3-methylbutyl 2-hydroxypropanoate |
| InChI Key | CRORGGSWAKIXSA-UHFFFAOYSA-N |
| Molecular Formula | C8H16O3 |
4-Methylvaleric Acid 97.0+%, TCI America™
CAS: 646-07-1 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 MDL Number: MFCD00002803 InChI Key: FGKJLKRYENPLQH-UHFFFAOYSA-N Synonym: 4-methylvaleric acid,isocaproic acid,isohexanoic acid,pentanoic acid, 4-methyl,isobutylacetic acid,4-methyl-pentanoic acid,valeric acid, 4-methyl,4-methyl valeric acid,isocaproate,4,4-dimethylbutanoic acid PubChem CID: 12587 ChEBI: CHEBI:74903 IUPAC Name: 4-methylpentanoic acid SMILES: CC(C)CCC(=O)O
| PubChem CID | 12587 |
|---|---|
| CAS | 646-07-1 |
| Molecular Weight (g/mol) | 116.16 |
| ChEBI | CHEBI:74903 |
| MDL Number | MFCD00002803 |
| SMILES | CC(C)CCC(=O)O |
| Synonym | 4-methylvaleric acid,isocaproic acid,isohexanoic acid,pentanoic acid, 4-methyl,isobutylacetic acid,4-methyl-pentanoic acid,valeric acid, 4-methyl,4-methyl valeric acid,isocaproate,4,4-dimethylbutanoic acid |
| IUPAC Name | 4-methylpentanoic acid |
| InChI Key | FGKJLKRYENPLQH-UHFFFAOYSA-N |
| Molecular Formula | C6H12O2 |
Ethyl all cis-5,8,11,14,17-Eicosapentaenoate (stabilized with Tocopherols) 65.0+%, TCI America™
CAS: 86227-47-6 Molecular Formula: C22H34O2 Molecular Weight (g/mol): 330.512 MDL Number: MFCD00673476 InChI Key: SSQPWTVBQMWLSZ-AAQCHOMXSA-N Synonym: all cis-5,8,11,14,17-Eicosapentaenoic Acid Ethyl Ester, EPA Ethyl Ester, Ethyl all cis-5,8,11,14,17-Icosapentaenoate PubChem CID: 9831415 ChEBI: CHEBI:84883 IUPAC Name: ethyl (5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoate SMILES: CCC=CCC=CCC=CCC=CCC=CCCCC(=O)OCC
| PubChem CID | 9831415 |
|---|---|
| CAS | 86227-47-6 |
| Molecular Weight (g/mol) | 330.512 |
| ChEBI | CHEBI:84883 |
| MDL Number | MFCD00673476 |
| SMILES | CCC=CCC=CCC=CCC=CCC=CCCCC(=O)OCC |
| Synonym | all cis-5,8,11,14,17-Eicosapentaenoic Acid Ethyl Ester, EPA Ethyl Ester, Ethyl all cis-5,8,11,14,17-Icosapentaenoate |
| IUPAC Name | ethyl (5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoate |
| InChI Key | SSQPWTVBQMWLSZ-AAQCHOMXSA-N |
| Molecular Formula | C22H34O2 |
Ethyl Heptanoate 98.0+%, TCI America™
CAS: 106-30-9 Molecular Formula: C9H18O2 Molecular Weight (g/mol): 158.24 MDL Number: MFCD00009538 InChI Key: TVQGDYNRXLTQAP-UHFFFAOYSA-N Synonym: ethyl enanthate,oenanthic ether,wine oil,ethyl heptylate,grape oil,ethyl heptoate,heptanoic acid, ethyl ester,cognac oil,enanthylic ether,ethyl oenanthate PubChem CID: 7797 ChEBI: CHEBI:86618 IUPAC Name: ethyl heptanoate SMILES: CCCCCCC(=O)OCC
| PubChem CID | 7797 |
|---|---|
| CAS | 106-30-9 |
| Molecular Weight (g/mol) | 158.24 |
| ChEBI | CHEBI:86618 |
| MDL Number | MFCD00009538 |
| SMILES | CCCCCCC(=O)OCC |
| Synonym | ethyl enanthate,oenanthic ether,wine oil,ethyl heptylate,grape oil,ethyl heptoate,heptanoic acid, ethyl ester,cognac oil,enanthylic ether,ethyl oenanthate |
| IUPAC Name | ethyl heptanoate |
| InChI Key | TVQGDYNRXLTQAP-UHFFFAOYSA-N |
| Molecular Formula | C9H18O2 |
2-Naphthyl Acetate 98.0+%, TCI America™
CAS: 1523-11-1 Molecular Formula: C12H10O2 Molecular Weight (g/mol): 186.21 MDL Number: MFCD00004060 InChI Key: RJNPPEUAJCEUPV-UHFFFAOYSA-N Synonym: 2-naphthyl acetate,2-acetoxynaphthalene,2-naphthalenol, acetate,beta-naphthyl acetate,2-naphthol, acetate,naphthalene, 2-acetoxy,2-naphthalenol, 2-acetate,.beta.-naphthol acetate,.beta.-naphthyl acetate,o-acetyl-.beta.-naphthol PubChem CID: 73709 IUPAC Name: naphthalen-2-yl acetate SMILES: CC(=O)OC1=CC=C2C=CC=CC2=C1
| PubChem CID | 73709 |
|---|---|
| CAS | 1523-11-1 |
| Molecular Weight (g/mol) | 186.21 |
| MDL Number | MFCD00004060 |
| SMILES | CC(=O)OC1=CC=C2C=CC=CC2=C1 |
| Synonym | 2-naphthyl acetate,2-acetoxynaphthalene,2-naphthalenol, acetate,beta-naphthyl acetate,2-naphthol, acetate,naphthalene, 2-acetoxy,2-naphthalenol, 2-acetate,.beta.-naphthol acetate,.beta.-naphthyl acetate,o-acetyl-.beta.-naphthol |
| IUPAC Name | naphthalen-2-yl acetate |
| InChI Key | RJNPPEUAJCEUPV-UHFFFAOYSA-N |
| Molecular Formula | C12H10O2 |
alpha-Cyclohexylphenylacetic Acid 95.0+%, TCI America™
CAS: 3894-09-5 Molecular Formula: C14H17O2 Molecular Weight (g/mol): 217.29 MDL Number: MFCD00001477 InChI Key: AAJLPPDFIRPBDA-ZDUSSCGKSA-M Synonym: 2-Cyclohexyl-2-phenylacetic Acid PubChem CID: 97942 IUPAC Name: 2-cyclohexyl-2-phenylacetic acid SMILES: C1CCC(CC1)C(C2=CC=CC=C2)C(=O)O
| PubChem CID | 97942 |
|---|---|
| CAS | 3894-09-5 |
| Molecular Weight (g/mol) | 217.29 |
| MDL Number | MFCD00001477 |
| SMILES | C1CCC(CC1)C(C2=CC=CC=C2)C(=O)O |
| Synonym | 2-Cyclohexyl-2-phenylacetic Acid |
| IUPAC Name | 2-cyclohexyl-2-phenylacetic acid |
| InChI Key | AAJLPPDFIRPBDA-ZDUSSCGKSA-M |
| Molecular Formula | C14H17O2 |
Ethyl 4,5,6,7-Tetrahydroisoindole-1-carboxylate 95.0+%, TCI America™
CAS: 65880-17-3 Molecular Formula: C11H15NO2 Molecular Weight (g/mol): 193.246 MDL Number: MFCD06227773 InChI Key: NIMDFIORBNYIGB-UHFFFAOYSA-N Synonym: 4,5,6,7-Tetrahydroisoindole-1-carboxylic Acid Ethyl Ester PubChem CID: 10035498 IUPAC Name: ethyl 4,5,6,7-tetrahydro-2H-isoindole-1-carboxylate SMILES: CCOC(=O)C1=C2CCCCC2=CN1
| PubChem CID | 10035498 |
|---|---|
| CAS | 65880-17-3 |
| Molecular Weight (g/mol) | 193.246 |
| MDL Number | MFCD06227773 |
| SMILES | CCOC(=O)C1=C2CCCCC2=CN1 |
| Synonym | 4,5,6,7-Tetrahydroisoindole-1-carboxylic Acid Ethyl Ester |
| IUPAC Name | ethyl 4,5,6,7-tetrahydro-2H-isoindole-1-carboxylate |
| InChI Key | NIMDFIORBNYIGB-UHFFFAOYSA-N |
| Molecular Formula | C11H15NO2 |
Propyl Butyrate 98.0+%, TCI America™
CAS: 105-66-8 Molecular Formula: C7H14O2 Molecular Weight (g/mol): 130.187 MDL Number: MFCD00009396 InChI Key: HUAZGNHGCJGYNP-UHFFFAOYSA-N Synonym: propyl butyrate,butanoic acid, propyl ester,propyl n-butyrate,butyric acid, propyl ester,1-propyl butyrate,n-propyl butyrate,n-propyl n-butyrate,n-propyl-n-butanoate,n-butyric acid n-propyl ester,butyric acid propyl ester PubChem CID: 7770 IUPAC Name: propyl butanoate SMILES: CCCC(=O)OCCC
| PubChem CID | 7770 |
|---|---|
| CAS | 105-66-8 |
| Molecular Weight (g/mol) | 130.187 |
| MDL Number | MFCD00009396 |
| SMILES | CCCC(=O)OCCC |
| Synonym | propyl butyrate,butanoic acid, propyl ester,propyl n-butyrate,butyric acid, propyl ester,1-propyl butyrate,n-propyl butyrate,n-propyl n-butyrate,n-propyl-n-butanoate,n-butyric acid n-propyl ester,butyric acid propyl ester |
| IUPAC Name | propyl butanoate |
| InChI Key | HUAZGNHGCJGYNP-UHFFFAOYSA-N |
| Molecular Formula | C7H14O2 |