Organic acids and derivatives
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Octadecylamine Acetate 60.0+%, TCI America™
CAS: 2190-04-7 Molecular Formula: C20H43NO2 Molecular Weight (g/mol): 329.57 MDL Number: MFCD00060198 InChI Key: UPHWVVKYDQHTCF-UHFFFAOYSA-N Synonym: Aminooctadecane Acetate, Stearylamine Acetate, Octadecan-1-amine Acetate PubChem CID: 255899 IUPAC Name: acetic acid;octadecan-1-amine SMILES: CCCCCCCCCCCCCCCCCCN.CC(=O)O
| PubChem CID | 255899 |
|---|---|
| CAS | 2190-04-7 |
| Molecular Weight (g/mol) | 329.57 |
| MDL Number | MFCD00060198 |
| SMILES | CCCCCCCCCCCCCCCCCCN.CC(=O)O |
| Synonym | Aminooctadecane Acetate, Stearylamine Acetate, Octadecan-1-amine Acetate |
| IUPAC Name | acetic acid;octadecan-1-amine |
| InChI Key | UPHWVVKYDQHTCF-UHFFFAOYSA-N |
| Molecular Formula | C20H43NO2 |
O-Acetyl-N-carbobenzoxyhydroxylamine 98.0+%, TCI America™
CAS: 180798-01-0 Molecular Formula: C10H11NO4 Molecular Weight (g/mol): 209.201 InChI Key: YEIRDDKOGLZHLP-UHFFFAOYSA-N Synonym: O-Acetyl-N-Cbz-hydroxylamine, N-Acetoxycarbamic Acid Benzyl Ester, Benzyl N-Acetoxycarbamate PubChem CID: 10954788 IUPAC Name: phenylmethoxycarbonylamino acetate SMILES: CC(=O)ONC(=O)OCC1=CC=CC=C1
| PubChem CID | 10954788 |
|---|---|
| CAS | 180798-01-0 |
| Molecular Weight (g/mol) | 209.201 |
| SMILES | CC(=O)ONC(=O)OCC1=CC=CC=C1 |
| Synonym | O-Acetyl-N-Cbz-hydroxylamine, N-Acetoxycarbamic Acid Benzyl Ester, Benzyl N-Acetoxycarbamate |
| IUPAC Name | phenylmethoxycarbonylamino acetate |
| InChI Key | YEIRDDKOGLZHLP-UHFFFAOYSA-N |
| Molecular Formula | C10H11NO4 |
Isoamyl Laurate 97.0+%, TCI America™
CAS: 6309-51-9 Molecular Formula: C17H34O2 Molecular Weight (g/mol): 270.457 MDL Number: MFCD00048429 InChI Key: FVKRIDSRWFEQME-UHFFFAOYSA-N Synonym: isoamyl laurate,isopentyl laurate,dodecanoic acid, 3-methylbutyl ester,lauric acid, isopentyl ester,isoamyl dodecanoate,isopentyl dodecanoate,lauric acid isoamyl ester,isopentyl dodecylate,unii-m1slx00m3m,iso-amyl n-dodecanoate PubChem CID: 61386 ChEBI: CHEBI:87343 IUPAC Name: 3-methylbutyl dodecanoate SMILES: CCCCCCCCCCCC(=O)OCCC(C)C
| PubChem CID | 61386 |
|---|---|
| CAS | 6309-51-9 |
| Molecular Weight (g/mol) | 270.457 |
| ChEBI | CHEBI:87343 |
| MDL Number | MFCD00048429 |
| SMILES | CCCCCCCCCCCC(=O)OCCC(C)C |
| Synonym | isoamyl laurate,isopentyl laurate,dodecanoic acid, 3-methylbutyl ester,lauric acid, isopentyl ester,isoamyl dodecanoate,isopentyl dodecanoate,lauric acid isoamyl ester,isopentyl dodecylate,unii-m1slx00m3m,iso-amyl n-dodecanoate |
| IUPAC Name | 3-methylbutyl dodecanoate |
| InChI Key | FVKRIDSRWFEQME-UHFFFAOYSA-N |
| Molecular Formula | C17H34O2 |
trans-4-Butylcyclohexanecarboxylic Acid 99.0+%, TCI America™
CAS: 38289-28-0 Molecular Formula: C11H20O2 Molecular Weight (g/mol): 184.279 MDL Number: MFCD00059560 InChI Key: BALGERHMIXFENA-UHFFFAOYSA-N Synonym: trans-4-butylcyclohexanecarboxylic acid,4-butylcyclohexanecarboxylic acid,trans-4-n-butylcyclohexanecarboxylic acid,4-butylcyclohexane carboxylic acid,4-n-butylcyclohexanecarboxylic acid,cyclohexanecarboxylic acid, 4-butyl,trans-4-butylcyclohexane carboxylic acid,4-butylcyclohexanecarboxylic acid cis-and trans-mixture,cyclohexanecarboxylic acid, 4-butyl-, trans,enamine_005334 PubChem CID: 2060518 IUPAC Name: 4-butylcyclohexane-1-carboxylic acid SMILES: CCCCC1CCC(CC1)C(=O)O
| PubChem CID | 2060518 |
|---|---|
| CAS | 38289-28-0 |
| Molecular Weight (g/mol) | 184.279 |
| MDL Number | MFCD00059560 |
| SMILES | CCCCC1CCC(CC1)C(=O)O |
| Synonym | trans-4-butylcyclohexanecarboxylic acid,4-butylcyclohexanecarboxylic acid,trans-4-n-butylcyclohexanecarboxylic acid,4-butylcyclohexane carboxylic acid,4-n-butylcyclohexanecarboxylic acid,cyclohexanecarboxylic acid, 4-butyl,trans-4-butylcyclohexane carboxylic acid,4-butylcyclohexanecarboxylic acid cis-and trans-mixture,cyclohexanecarboxylic acid, 4-butyl-, trans,enamine_005334 |
| IUPAC Name | 4-butylcyclohexane-1-carboxylic acid |
| InChI Key | BALGERHMIXFENA-UHFFFAOYSA-N |
| Molecular Formula | C11H20O2 |
o-Tolylacetic Acid 98.0+%, TCI America™
CAS: 644-36-0 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.177 MDL Number: MFCD00004328 InChI Key: RZWGTXHSYZGXKF-UHFFFAOYSA-N Synonym: o-tolylacetic acid,2-methylphenylacetic acid,2-methylphenyl acetic acid,2-2-methylphenyl acetic acid,2-o-tolyl acetic acid,2-tolylacetic acid,2-o-tolylacetic acid,o-methylphenylacetic acid,o-tolyacetic acid PubChem CID: 69519 IUPAC Name: 2-(2-methylphenyl)acetic acid SMILES: CC1=CC=CC=C1CC(=O)O
| PubChem CID | 69519 |
|---|---|
| CAS | 644-36-0 |
| Molecular Weight (g/mol) | 150.177 |
| MDL Number | MFCD00004328 |
| SMILES | CC1=CC=CC=C1CC(=O)O |
| Synonym | o-tolylacetic acid,2-methylphenylacetic acid,2-methylphenyl acetic acid,2-2-methylphenyl acetic acid,2-o-tolyl acetic acid,2-tolylacetic acid,2-o-tolylacetic acid,o-methylphenylacetic acid,o-tolyacetic acid |
| IUPAC Name | 2-(2-methylphenyl)acetic acid |
| InChI Key | RZWGTXHSYZGXKF-UHFFFAOYSA-N |
| Molecular Formula | C9H10O2 |
Indazole-3-carboxylic Acid 98.0+%, TCI America™
CAS: 4498-67-3 Molecular Formula: C8H6N2O2 Molecular Weight (g/mol): 162.148 MDL Number: MFCD00211066 InChI Key: BHXVYTQDWMQVBI-UHFFFAOYSA-N Synonym: indazole-3-carboxylic acid,3-carboxyindazole,3-indazolecarboxylic acid,indazole-3-carboxylicacid,1h-indazol-3-carbonic acid,2h-indazole-3-carboxylic acid,3-carboxy-1h-indazole,1h-indazole-3-carbonic acid,1-h-indazole-3-carboxylic acid,benzopyrazole-3-carboxylic acid PubChem CID: 78250 IUPAC Name: 1H-indazole-3-carboxylic acid SMILES: C1=CC=C2C(=C1)C(=NN2)C(=O)O
| PubChem CID | 78250 |
|---|---|
| CAS | 4498-67-3 |
| Molecular Weight (g/mol) | 162.148 |
| MDL Number | MFCD00211066 |
| SMILES | C1=CC=C2C(=C1)C(=NN2)C(=O)O |
| Synonym | indazole-3-carboxylic acid,3-carboxyindazole,3-indazolecarboxylic acid,indazole-3-carboxylicacid,1h-indazol-3-carbonic acid,2h-indazole-3-carboxylic acid,3-carboxy-1h-indazole,1h-indazole-3-carbonic acid,1-h-indazole-3-carboxylic acid,benzopyrazole-3-carboxylic acid |
| IUPAC Name | 1H-indazole-3-carboxylic acid |
| InChI Key | BHXVYTQDWMQVBI-UHFFFAOYSA-N |
| Molecular Formula | C8H6N2O2 |
Ethyl 2-Methyl-4-pentenoate 98.0+%, TCI America™
CAS: 53399-81-8 Molecular Formula: C8H14O2 Molecular Weight (g/mol): 142.20 MDL Number: MFCD00010235 InChI Key: BDBGKYIBDXAVMX-UHFFFAOYNA-N Synonym: ethyl 2-methyl-4-pentenoate,2-methyl-4-pentenoic acid ethyl ester,ethyl 2-methyl 4-pentenoate,4-pentenoic acid, 2-methyl-, ethyl ester,ethyl 2-methylpent-4-en-1-oate,ethyl 2-methyl-4-pentanoate,fema no. 3489,pineapple pentenoate,acmc-1ao14,ethyl-2-methyl-4-pentenoate PubChem CID: 62024 IUPAC Name: ethyl 2-methylpent-4-enoate SMILES: CCOC(=O)C(C)CC=C
| PubChem CID | 62024 |
|---|---|
| CAS | 53399-81-8 |
| Molecular Weight (g/mol) | 142.20 |
| MDL Number | MFCD00010235 |
| SMILES | CCOC(=O)C(C)CC=C |
| Synonym | ethyl 2-methyl-4-pentenoate,2-methyl-4-pentenoic acid ethyl ester,ethyl 2-methyl 4-pentenoate,4-pentenoic acid, 2-methyl-, ethyl ester,ethyl 2-methylpent-4-en-1-oate,ethyl 2-methyl-4-pentanoate,fema no. 3489,pineapple pentenoate,acmc-1ao14,ethyl-2-methyl-4-pentenoate |
| IUPAC Name | ethyl 2-methylpent-4-enoate |
| InChI Key | BDBGKYIBDXAVMX-UHFFFAOYNA-N |
| Molecular Formula | C8H14O2 |
Isoamyl Hexanoate 98.0+%, 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 Isoamyl Ester, Isopentyl Hexanoate, Hexanoic Acid Isopentyl 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 Isoamyl Ester, Isopentyl Hexanoate, Hexanoic Acid Isopentyl Ester |
| IUPAC Name | 3-methylbutyl hexanoate |
| InChI Key | XVSZRAWFCDHCBP-UHFFFAOYSA-N |
| Molecular Formula | C11H22O2 |
Benzyl Propionate 99.0+%, TCI America™
CAS: 122-63-4 Molecular Formula: C10H12O2 Molecular Weight (g/mol): 164.20 MDL Number: MFCD00027003 InChI Key: VHOMAPWVLKRQAZ-UHFFFAOYSA-N Synonym: benzyl propionate,propanoic acid, phenylmethyl ester,propionic acid, benzyl ester,phenylmethyl propanoate,propionic acid benzyl ester,phenylmethyl propionate,benzyl propionate natrual,benzyl n-propionate,fema no. 2150,propionic acid, benzyl ester 6ci,7ci,8ci PubChem CID: 31219 IUPAC Name: benzyl propanoate SMILES: CCC(=O)OCC1=CC=CC=C1
| PubChem CID | 31219 |
|---|---|
| CAS | 122-63-4 |
| Molecular Weight (g/mol) | 164.20 |
| MDL Number | MFCD00027003 |
| SMILES | CCC(=O)OCC1=CC=CC=C1 |
| Synonym | benzyl propionate,propanoic acid, phenylmethyl ester,propionic acid, benzyl ester,phenylmethyl propanoate,propionic acid benzyl ester,phenylmethyl propionate,benzyl propionate natrual,benzyl n-propionate,fema no. 2150,propionic acid, benzyl ester 6ci,7ci,8ci |
| IUPAC Name | benzyl propanoate |
| InChI Key | VHOMAPWVLKRQAZ-UHFFFAOYSA-N |
| Molecular Formula | C10H12O2 |
Pyridazine-4-carboxylic Acid 98.0+%, TCI America™
CAS: 50681-25-9 Molecular Formula: C5H4N2O2 Molecular Weight (g/mol): 124.099 MDL Number: MFCD00011576 InChI Key: JUSIWJONLKBPDU-UHFFFAOYSA-N Synonym: 4-pyridazinecarboxylic acid,4-carboxypyridazine,4-pyridazinecarboxylicacid,pubchem9501,acmc-1alr8,pyridazin-4-carboxylic acid,4-pyridazine-carboxylic acid,ksc269i2f,pyridazin-4-yl formate,1,2-diazine-4-carboxylic acid PubChem CID: 2761046 IUPAC Name: pyridazine-4-carboxylic acid SMILES: C1=CN=NC=C1C(=O)O
| PubChem CID | 2761046 |
|---|---|
| CAS | 50681-25-9 |
| Molecular Weight (g/mol) | 124.099 |
| MDL Number | MFCD00011576 |
| SMILES | C1=CN=NC=C1C(=O)O |
| Synonym | 4-pyridazinecarboxylic acid,4-carboxypyridazine,4-pyridazinecarboxylicacid,pubchem9501,acmc-1alr8,pyridazin-4-carboxylic acid,4-pyridazine-carboxylic acid,ksc269i2f,pyridazin-4-yl formate,1,2-diazine-4-carboxylic acid |
| IUPAC Name | pyridazine-4-carboxylic acid |
| InChI Key | JUSIWJONLKBPDU-UHFFFAOYSA-N |
| Molecular Formula | C5H4N2O2 |
Isobutyric Anhydride 95.0+%, TCI America™
CAS: 97-72-3 Molecular Formula: C8H14O3 Molecular Weight (g/mol): 158.197 MDL Number: MFCD00008913 InChI Key: LSACYLWPPQLVSM-UHFFFAOYSA-N Synonym: isobutyric anhydride,isobutyric acid anhydride,propanoic acid, 2-methyl-, anhydride,2-methylpropanoic anhydride,isobutyricanhydride,isobutyryl anhydride,2-methylpropionic anhydride,unii-n85a80fjdt,n85a80fjdt,2-methylpropanoic acid anhydride PubChem CID: 7346 ChEBI: CHEBI:84261 IUPAC Name: 2-methylpropanoyl 2-methylpropanoate SMILES: CC(C)C(=O)OC(=O)C(C)C
| PubChem CID | 7346 |
|---|---|
| CAS | 97-72-3 |
| Molecular Weight (g/mol) | 158.197 |
| ChEBI | CHEBI:84261 |
| MDL Number | MFCD00008913 |
| SMILES | CC(C)C(=O)OC(=O)C(C)C |
| Synonym | isobutyric anhydride,isobutyric acid anhydride,propanoic acid, 2-methyl-, anhydride,2-methylpropanoic anhydride,isobutyricanhydride,isobutyryl anhydride,2-methylpropionic anhydride,unii-n85a80fjdt,n85a80fjdt,2-methylpropanoic acid anhydride |
| IUPAC Name | 2-methylpropanoyl 2-methylpropanoate |
| InChI Key | LSACYLWPPQLVSM-UHFFFAOYSA-N |
| Molecular Formula | C8H14O3 |
Isobutyl Butyrate 98.0+%, TCI America™
CAS: 539-90-2 Molecular Formula: C8H16O2 Molecular Weight (g/mol): 144.21 MDL Number: MFCD00027134 InChI Key: RGFNRWTWDWVHDD-UHFFFAOYSA-N Synonym: Butyric Acid Isobutyl Ester PubChem CID: 10885 ChEBI: CHEBI:87683 IUPAC Name: 2-methylpropyl butanoate SMILES: CCCC(=O)OCC(C)C
| PubChem CID | 10885 |
|---|---|
| CAS | 539-90-2 |
| Molecular Weight (g/mol) | 144.21 |
| ChEBI | CHEBI:87683 |
| MDL Number | MFCD00027134 |
| SMILES | CCCC(=O)OCC(C)C |
| Synonym | Butyric Acid Isobutyl Ester |
| IUPAC Name | 2-methylpropyl butanoate |
| InChI Key | RGFNRWTWDWVHDD-UHFFFAOYSA-N |
| Molecular Formula | C8H16O2 |
Ethyl 3-Cyclopentene-1-carboxylate 97.0+%, TCI America™
CAS: 21622-01-5 Molecular Formula: C8H12O2 Molecular Weight (g/mol): 140.182 MDL Number: MFCD06410819 InChI Key: CTLAIKSGNQPPLO-UHFFFAOYSA-N Synonym: 3-Cyclopentene-1-carboxylic Acid Ethyl Ester PubChem CID: 5314991 IUPAC Name: ethyl cyclopent-3-ene-1-carboxylate SMILES: CCOC(=O)C1CC=CC1
| PubChem CID | 5314991 |
|---|---|
| CAS | 21622-01-5 |
| Molecular Weight (g/mol) | 140.182 |
| MDL Number | MFCD06410819 |
| SMILES | CCOC(=O)C1CC=CC1 |
| Synonym | 3-Cyclopentene-1-carboxylic Acid Ethyl Ester |
| IUPAC Name | ethyl cyclopent-3-ene-1-carboxylate |
| InChI Key | CTLAIKSGNQPPLO-UHFFFAOYSA-N |
| Molecular Formula | C8H12O2 |
4-Butylcyclohexanecarboxylic Acid (cis- and trans- mixture) 98.0+%, TCI America™
CAS: 71101-89-8 Molecular Formula: C11H20O2 Molecular Weight (g/mol): 184.279 MDL Number: MFCD00460757 InChI Key: BALGERHMIXFENA-UHFFFAOYSA-N PubChem CID: 2060518 IUPAC Name: 4-butylcyclohexane-1-carboxylic acid SMILES: CCCCC1CCC(CC1)C(=O)O
| PubChem CID | 2060518 |
|---|---|
| CAS | 71101-89-8 |
| Molecular Weight (g/mol) | 184.279 |
| MDL Number | MFCD00460757 |
| SMILES | CCCCC1CCC(CC1)C(=O)O |
| IUPAC Name | 4-butylcyclohexane-1-carboxylic acid |
| InChI Key | BALGERHMIXFENA-UHFFFAOYSA-N |
| Molecular Formula | C11H20O2 |