Carboxylic acids and derivatives
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2-(Methylamino)isobutyric Acid Hydrate 98.0+%, TCI America™
CAS: 2566-34-9 Molecular Formula: C5H11NO2 Molecular Weight (g/mol): 117.148 MDL Number: MFCD00004191 InChI Key: DLAMVQGYEVKIRE-UHFFFAOYSA-N Synonym: 2-methylamino isobutyric acid,n,2-dimethylalanine,2-methyl-2-methylamino propanoic acid,alpha-methylamino isobutyric acid,meaib,alanine, n,2-dimethyl,n-methyl-a-aminoisobutyric acid,2-methylamino-2-methylpropionic acid,alpha-methylamino-isobutyric acid,2,n-dimethylalanine PubChem CID: 75725 IUPAC Name: 2-methyl-2-(methylamino)propanoic acid SMILES: CC(C)(C(=O)O)NC
| PubChem CID | 75725 |
|---|---|
| CAS | 2566-34-9 |
| Molecular Weight (g/mol) | 117.148 |
| MDL Number | MFCD00004191 |
| SMILES | CC(C)(C(=O)O)NC |
| Synonym | 2-methylamino isobutyric acid,n,2-dimethylalanine,2-methyl-2-methylamino propanoic acid,alpha-methylamino isobutyric acid,meaib,alanine, n,2-dimethyl,n-methyl-a-aminoisobutyric acid,2-methylamino-2-methylpropionic acid,alpha-methylamino-isobutyric acid,2,n-dimethylalanine |
| IUPAC Name | 2-methyl-2-(methylamino)propanoic acid |
| InChI Key | DLAMVQGYEVKIRE-UHFFFAOYSA-N |
| Molecular Formula | C5H11NO2 |
Ethyl trans-4-Decenoate 98.0+%, TCI America™
CAS: 76649-16-6 Molecular Formula: C12H22O2 Molecular Weight (g/mol): 198.31 MDL Number: MFCD00015574 InChI Key: AWNIQMQADACLCJ-CMDGGOBGSA-N Synonym: ethyl trans-4-decenoate,ethyl e-4-decenoate,ethyl 4-decenoate,4-decenoic acid, ethyl ester, e,ethyl 4e-decenoate,fema no. 3642,ethyl 4e-dec-4-enoate,ethyl trans-dec-4-enoate,ethyl e-dec-4-enoate,ethyl 4e-4-decenoate PubChem CID: 5362583 IUPAC Name: ethyl (4E)-dec-4-enoate SMILES: CCCCC\C=C\CCC(=O)OCC
| PubChem CID | 5362583 |
|---|---|
| CAS | 76649-16-6 |
| Molecular Weight (g/mol) | 198.31 |
| MDL Number | MFCD00015574 |
| SMILES | CCCCC\C=C\CCC(=O)OCC |
| Synonym | ethyl trans-4-decenoate,ethyl e-4-decenoate,ethyl 4-decenoate,4-decenoic acid, ethyl ester, e,ethyl 4e-decenoate,fema no. 3642,ethyl 4e-dec-4-enoate,ethyl trans-dec-4-enoate,ethyl e-dec-4-enoate,ethyl 4e-4-decenoate |
| IUPAC Name | ethyl (4E)-dec-4-enoate |
| InChI Key | AWNIQMQADACLCJ-CMDGGOBGSA-N |
| Molecular Formula | C12H22O2 |
Butyl Propionate 99.0+%, TCI America™
CAS: 590-01-2 Molecular Formula: C7H14O2 Molecular Weight (g/mol): 130.187 MDL Number: MFCD00009448 InChI Key: BTMVHUNTONAYDX-UHFFFAOYSA-N Synonym: butyl propionate,n-butyl propionate,propanoic acid, butyl ester,n-butyl propanoate,propionic acid, butyl ester,propionic acid butyl ester,unii-2nxc4ak99e,butyl propionate natural,fema no. 2211,n-butyl n-propionate PubChem CID: 11529 IUPAC Name: butyl propanoate SMILES: CCCCOC(=O)CC
| PubChem CID | 11529 |
|---|---|
| CAS | 590-01-2 |
| Molecular Weight (g/mol) | 130.187 |
| MDL Number | MFCD00009448 |
| SMILES | CCCCOC(=O)CC |
| Synonym | butyl propionate,n-butyl propionate,propanoic acid, butyl ester,n-butyl propanoate,propionic acid, butyl ester,propionic acid butyl ester,unii-2nxc4ak99e,butyl propionate natural,fema no. 2211,n-butyl n-propionate |
| IUPAC Name | butyl propanoate |
| InChI Key | BTMVHUNTONAYDX-UHFFFAOYSA-N |
| Molecular Formula | C7H14O2 |
3-Noradamantanecarboxylic Acid 98.0+%, TCI America™
CAS: 16200-53-6 Molecular Formula: C10H14O2 Molecular Weight (g/mol): 166.22 MDL Number: MFCD00213463 InChI Key: RXUUYFUQAGICCD-NLZKFAMNSA-N Synonym: 3-noradamantanecarboxylic acid,3-noradamantane carboxylic acid,octahydro-2,5-methanopentalene-3a-carboxylic acid,2,5-methanopentalene-3a 1h-carboxylic acid, hexahydro,3-noradamantancarboxylic acid,3-noradamantanecarboxylicacid,rxuuyfuqagiccd-uhfffaoysa,3-noradamantanecarboxylate nac,hexahydro-2,5-methano-pentalene-3a-carboxylic acid,tricyclo 3.3.1.0<3,7> nonane-3-carboxylic acid PubChem CID: 11887834 SMILES: C1C2CC3CC1CC3(C2)C(=O)O
| PubChem CID | 11887834 |
|---|---|
| CAS | 16200-53-6 |
| Molecular Weight (g/mol) | 166.22 |
| MDL Number | MFCD00213463 |
| SMILES | C1C2CC3CC1CC3(C2)C(=O)O |
| Synonym | 3-noradamantanecarboxylic acid,3-noradamantane carboxylic acid,octahydro-2,5-methanopentalene-3a-carboxylic acid,2,5-methanopentalene-3a 1h-carboxylic acid, hexahydro,3-noradamantancarboxylic acid,3-noradamantanecarboxylicacid,rxuuyfuqagiccd-uhfffaoysa,3-noradamantanecarboxylate nac,hexahydro-2,5-methano-pentalene-3a-carboxylic acid,tricyclo 3.3.1.0<3,7> nonane-3-carboxylic acid |
| InChI Key | RXUUYFUQAGICCD-NLZKFAMNSA-N |
| Molecular Formula | C10H14O2 |
Propyl Gallate 98.0+%, TCI America™
CAS: 121-79-9 Molecular Formula: C10H12O5 Molecular Weight (g/mol): 212.201 MDL Number: MFCD00002196 InChI Key: ZTHYODDOHIVTJV-UHFFFAOYSA-N Synonym: propyl gallate,n-propyl gallate,progallin p,tenox pg,nipagallin p,gallic acid, propyl ester,gallic acid propyl ester,nipa 49,benzoic acid, 3,4,5-trihydroxy-, propyl ester,3,4,5-trihydroxybenzene-1-propylcarboxylate PubChem CID: 4947 ChEBI: CHEBI:10607 IUPAC Name: propyl 3,4,5-trihydroxybenzoate SMILES: CCCOC(=O)C1=CC(=C(C(=C1)O)O)O
| PubChem CID | 4947 |
|---|---|
| CAS | 121-79-9 |
| Molecular Weight (g/mol) | 212.201 |
| ChEBI | CHEBI:10607 |
| MDL Number | MFCD00002196 |
| SMILES | CCCOC(=O)C1=CC(=C(C(=C1)O)O)O |
| Synonym | propyl gallate,n-propyl gallate,progallin p,tenox pg,nipagallin p,gallic acid, propyl ester,gallic acid propyl ester,nipa 49,benzoic acid, 3,4,5-trihydroxy-, propyl ester,3,4,5-trihydroxybenzene-1-propylcarboxylate |
| IUPAC Name | propyl 3,4,5-trihydroxybenzoate |
| InChI Key | ZTHYODDOHIVTJV-UHFFFAOYSA-N |
| Molecular Formula | C10H12O5 |
Octadecyl 3-Mercaptopropionate (contains ca. 12% Hexadecyl 3-Mercaptopropionate) 85.0+%, TCI America™
CAS: 31778-15-1 Molecular Formula: C21H42O2S Molecular Weight (g/mol): 358.63 MDL Number: MFCD00046844 InChI Key: UCUPUEARJPTGKU-UHFFFAOYSA-N Synonym: 3-Mercaptopropionic Acid Octadecyl Ester, Stearyl 3-Mercaptopropionate, 3-Mercaptopropionic Acid Stearyl Ester PubChem CID: 169361 IUPAC Name: octadecyl 3-sulfanylpropanoate SMILES: CCCCCCCCCCCCCCCCCCOC(=O)CCS
| PubChem CID | 169361 |
|---|---|
| CAS | 31778-15-1 |
| Molecular Weight (g/mol) | 358.63 |
| MDL Number | MFCD00046844 |
| SMILES | CCCCCCCCCCCCCCCCCCOC(=O)CCS |
| Synonym | 3-Mercaptopropionic Acid Octadecyl Ester, Stearyl 3-Mercaptopropionate, 3-Mercaptopropionic Acid Stearyl Ester |
| IUPAC Name | octadecyl 3-sulfanylpropanoate |
| InChI Key | UCUPUEARJPTGKU-UHFFFAOYSA-N |
| Molecular Formula | C21H42O2S |
3-(4-Pyridyl)acrylic Acid 97.0+%, TCI America™
CAS: 5337-79-1 Molecular Formula: C8H7NO2 Molecular Weight (g/mol): 149.149 MDL Number: MFCD00040746 InChI Key: SSAYTINUCCRGDR-OWOJBTEDSA-N Synonym: 3-4-pyridyl acrylic acid,trans-3-4-pyridyl acrylic acid,3-pyridin-4-yl-acrylic acid,4-pyridineacrylic acid,e-3-pyridin-4-yl acrylic acid,3-pyridin-4-yl acrylic acid,2e-3-pyridin-4-ylacrylic acid,3-4-pyridine acrylic acid,2e-3-pyridin-4-yl prop-2-enoic acid,e-3-pyridin-4-yl-acrylic acid PubChem CID: 736782 IUPAC Name: (E)-3-pyridin-4-ylprop-2-enoic acid SMILES: C1=CN=CC=C1C=CC(=O)O
| PubChem CID | 736782 |
|---|---|
| CAS | 5337-79-1 |
| Molecular Weight (g/mol) | 149.149 |
| MDL Number | MFCD00040746 |
| SMILES | C1=CN=CC=C1C=CC(=O)O |
| Synonym | 3-4-pyridyl acrylic acid,trans-3-4-pyridyl acrylic acid,3-pyridin-4-yl-acrylic acid,4-pyridineacrylic acid,e-3-pyridin-4-yl acrylic acid,3-pyridin-4-yl acrylic acid,2e-3-pyridin-4-ylacrylic acid,3-4-pyridine acrylic acid,2e-3-pyridin-4-yl prop-2-enoic acid,e-3-pyridin-4-yl-acrylic acid |
| IUPAC Name | (E)-3-pyridin-4-ylprop-2-enoic acid |
| InChI Key | SSAYTINUCCRGDR-OWOJBTEDSA-N |
| Molecular Formula | C8H7NO2 |
Ethyl 10-Undecenoate 97.0+%, TCI America™
CAS: 692-86-4 Molecular Formula: C13H24O2 Molecular Weight (g/mol): 212.333 MDL Number: MFCD00009220 InChI Key: FXNFFCMITPHEIT-UHFFFAOYSA-N Synonym: 10-Undecenoic Acid Ethyl Ester PubChem CID: 12729 IUPAC Name: ethyl undec-10-enoate SMILES: CCOC(=O)CCCCCCCCC=C
| PubChem CID | 12729 |
|---|---|
| CAS | 692-86-4 |
| Molecular Weight (g/mol) | 212.333 |
| MDL Number | MFCD00009220 |
| SMILES | CCOC(=O)CCCCCCCCC=C |
| Synonym | 10-Undecenoic Acid Ethyl Ester |
| IUPAC Name | ethyl undec-10-enoate |
| InChI Key | FXNFFCMITPHEIT-UHFFFAOYSA-N |
| Molecular Formula | C13H24O2 |
Isobutyl Hexanoate 98.0+%, TCI America™
CAS: 105-79-3 Molecular Formula: C10H20O2 Molecular Weight (g/mol): 172.268 MDL Number: MFCD00048870 InChI Key: UXUPPWPIGVTVQI-UHFFFAOYSA-N Synonym: isobutyl hexanoate,isobutyl caproate,hexanoic acid, 2-methylpropyl ester,hexanoic acid, isobutyl ester,2-methyl-1-propyl caproate,n-caproic acid isobutyl ester,isobutyl caproate natural,unii-2a3x4w9gz0,fema no. 2202,iso-butyl n-hexanoate PubChem CID: 7775 ChEBI: CHEBI:87421 IUPAC Name: 2-methylpropyl hexanoate SMILES: CCCCCC(=O)OCC(C)C
| PubChem CID | 7775 |
|---|---|
| CAS | 105-79-3 |
| Molecular Weight (g/mol) | 172.268 |
| ChEBI | CHEBI:87421 |
| MDL Number | MFCD00048870 |
| SMILES | CCCCCC(=O)OCC(C)C |
| Synonym | isobutyl hexanoate,isobutyl caproate,hexanoic acid, 2-methylpropyl ester,hexanoic acid, isobutyl ester,2-methyl-1-propyl caproate,n-caproic acid isobutyl ester,isobutyl caproate natural,unii-2a3x4w9gz0,fema no. 2202,iso-butyl n-hexanoate |
| IUPAC Name | 2-methylpropyl hexanoate |
| InChI Key | UXUPPWPIGVTVQI-UHFFFAOYSA-N |
| Molecular Formula | C10H20O2 |
2-Methyl-1-naphthyl Acetate 98.0+%, TCI America™
CAS: 5697-02-9 Molecular Formula: C13H12O2 Molecular Weight (g/mol): 200.24 InChI Key: WVOAPRDRMLHUMI-UHFFFAOYSA-N Synonym: Acetic Acid 2-Methyl-1-naphthyl Ester, 1-Acetoxy-2-methylnaphthalene PubChem CID: 11805727 IUPAC Name: (2-methylnaphthalen-1-yl) acetate SMILES: CC1=C(C2=CC=CC=C2C=C1)OC(=O)C
| PubChem CID | 11805727 |
|---|---|
| CAS | 5697-02-9 |
| Molecular Weight (g/mol) | 200.24 |
| SMILES | CC1=C(C2=CC=CC=C2C=C1)OC(=O)C |
| Synonym | Acetic Acid 2-Methyl-1-naphthyl Ester, 1-Acetoxy-2-methylnaphthalene |
| IUPAC Name | (2-methylnaphthalen-1-yl) acetate |
| InChI Key | WVOAPRDRMLHUMI-UHFFFAOYSA-N |
| Molecular Formula | C13H12O2 |
Ethyl 2-Thiophenecarboxylate 98.0+%, TCI America™
CAS: 2810-04-0 Molecular Formula: C7H8O2S Molecular Weight (g/mol): 156.20 MDL Number: MFCD00005436 InChI Key: JZGZKRJVTIRPOK-UHFFFAOYSA-N Synonym: ethyl 2-thiophenecarboxylate,ethyl 2-thenoate,ethyl-2-thiophenecarboxylate,thiophene-2-carboxylic acid ethyl ester,2-thiophenecarboxylic acid ethyl ester,thiophene, 2-ethyl carboxylate,thiophenecarboxylic acid, ethyl ester,ethylthiophen-2-carboxylat,ethyl2-thiophenecarboxylate,acmc-209h0w PubChem CID: 76052 IUPAC Name: ethyl thiophene-2-carboxylate SMILES: CCOC(=O)C1=CC=CS1
| PubChem CID | 76052 |
|---|---|
| CAS | 2810-04-0 |
| Molecular Weight (g/mol) | 156.20 |
| MDL Number | MFCD00005436 |
| SMILES | CCOC(=O)C1=CC=CS1 |
| Synonym | ethyl 2-thiophenecarboxylate,ethyl 2-thenoate,ethyl-2-thiophenecarboxylate,thiophene-2-carboxylic acid ethyl ester,2-thiophenecarboxylic acid ethyl ester,thiophene, 2-ethyl carboxylate,thiophenecarboxylic acid, ethyl ester,ethylthiophen-2-carboxylat,ethyl2-thiophenecarboxylate,acmc-209h0w |
| IUPAC Name | ethyl thiophene-2-carboxylate |
| InChI Key | JZGZKRJVTIRPOK-UHFFFAOYSA-N |
| Molecular Formula | C7H8O2S |
Isoamyl Hexanoate (contains 2-Methylbutyl Hexanoate) 97.0+%, TCI America™
CAS: 2198-61-0 Molecular Formula: C11H22O2 Molecular Weight (g/mol): 186.295 MDL Number: MFCD00027280 InChI Key: XVSZRAWFCDHCBP-UHFFFAOYSA-N Synonym: Hexanoic Acid Isopentyl Ester, Isopentyl Hexanoate, Hexanoic Acid Isoamyl Ester PubChem CID: 16617 ChEBI: CHEBI:87542 IUPAC Name: 3-methylbutyl hexanoate SMILES: CCCCCC(=O)OCCC(C)C
| PubChem CID | 16617 |
|---|---|
| CAS | 2198-61-0 |
| Molecular Weight (g/mol) | 186.295 |
| ChEBI | CHEBI:87542 |
| MDL Number | MFCD00027280 |
| SMILES | CCCCCC(=O)OCCC(C)C |
| Synonym | Hexanoic Acid Isopentyl Ester, Isopentyl Hexanoate, Hexanoic Acid Isoamyl Ester |
| IUPAC Name | 3-methylbutyl hexanoate |
| InChI Key | XVSZRAWFCDHCBP-UHFFFAOYSA-N |
| Molecular Formula | C11H22O2 |
Cyclohexylmethyl Acetate 98.0+%, TCI America™
CAS: 937-55-3 Molecular Formula: C9H16O2 Molecular Weight (g/mol): 156.23 MDL Number: MFCD07780584 InChI Key: FXKHUBNHBYCRNH-UHFFFAOYSA-N Synonym: Acetic Acid Cyclohexylmethyl Ester PubChem CID: 244762 IUPAC Name: cyclohexylmethyl acetate SMILES: CC(=O)OCC1CCCCC1
| PubChem CID | 244762 |
|---|---|
| CAS | 937-55-3 |
| Molecular Weight (g/mol) | 156.23 |
| MDL Number | MFCD07780584 |
| SMILES | CC(=O)OCC1CCCCC1 |
| Synonym | Acetic Acid Cyclohexylmethyl Ester |
| IUPAC Name | cyclohexylmethyl acetate |
| InChI Key | FXKHUBNHBYCRNH-UHFFFAOYSA-N |
| Molecular Formula | C9H16O2 |
1-(Mercaptomethyl)cyclopropaneacetic Acid 97.0+%, TCI America™
CAS: 162515-68-6 Molecular Formula: C6H10O2S Molecular Weight (g/mol): 146.204 MDL Number: MFCD03411600 InChI Key: VFAXPOVKNPTBTM-UHFFFAOYSA-N Synonym: 2-1-mercaptomethyl cyclopropyl acetic acid,1-mercaptomethyl cyclopropaneacetic acid,1-mercaptomethyl cyclopropylacetic acid,1-mercaptomethyl-cyclopropaneacetic acid,unii-1x00t93wyx,cyclopropaneacetic acid, 1-mercaptomethyl,2-1-sulfanylmethyl cyclopropyl acetic acid,1-mercaptomethyl cyclopropyl acetic acid,1-sulfanylmethyl cyclopropyl acetic acid PubChem CID: 9793825 IUPAC Name: 2-[1-(sulfanylmethyl)cyclopropyl]acetic acid SMILES: C1CC1(CC(=O)O)CS
| PubChem CID | 9793825 |
|---|---|
| CAS | 162515-68-6 |
| Molecular Weight (g/mol) | 146.204 |
| MDL Number | MFCD03411600 |
| SMILES | C1CC1(CC(=O)O)CS |
| Synonym | 2-1-mercaptomethyl cyclopropyl acetic acid,1-mercaptomethyl cyclopropaneacetic acid,1-mercaptomethyl cyclopropylacetic acid,1-mercaptomethyl-cyclopropaneacetic acid,unii-1x00t93wyx,cyclopropaneacetic acid, 1-mercaptomethyl,2-1-sulfanylmethyl cyclopropyl acetic acid,1-mercaptomethyl cyclopropyl acetic acid,1-sulfanylmethyl cyclopropyl acetic acid |
| IUPAC Name | 2-[1-(sulfanylmethyl)cyclopropyl]acetic acid |
| InChI Key | VFAXPOVKNPTBTM-UHFFFAOYSA-N |
| Molecular Formula | C6H10O2S |
Cyclohexanecarboxylic Acid 98.0+%, TCI America™
CAS: 98-89-5 Molecular Formula: C7H12O2 Molecular Weight (g/mol): 128.171 MDL Number: MFCD00001461 InChI Key: NZNMSOFKMUBTKW-UHFFFAOYSA-N Synonym: hexahydrobenzoic acid,carboxycyclohexane,cyclohexanoic acid,cyclohexylcarboxylic acid,cyclohexylmethanoic acid,cyclohexylformic acid,benzoic acid, hexahydro,cyclohexancarbonsaeure,cyclohexane-1-carboxylate,cyclohexanecarboxylicacid PubChem CID: 7413 ChEBI: CHEBI:36096 IUPAC Name: cyclohexanecarboxylic acid SMILES: C1CCC(CC1)C(=O)O
| PubChem CID | 7413 |
|---|---|
| CAS | 98-89-5 |
| Molecular Weight (g/mol) | 128.171 |
| ChEBI | CHEBI:36096 |
| MDL Number | MFCD00001461 |
| SMILES | C1CCC(CC1)C(=O)O |
| Synonym | hexahydrobenzoic acid,carboxycyclohexane,cyclohexanoic acid,cyclohexylcarboxylic acid,cyclohexylmethanoic acid,cyclohexylformic acid,benzoic acid, hexahydro,cyclohexancarbonsaeure,cyclohexane-1-carboxylate,cyclohexanecarboxylicacid |
| IUPAC Name | cyclohexanecarboxylic acid |
| InChI Key | NZNMSOFKMUBTKW-UHFFFAOYSA-N |
| Molecular Formula | C7H12O2 |