Isopentyl 4-aminobenzoate
3-methylbutyl 4-aminobenzoate
Also Known As: Isopentyl 4-aminobenzoate|3-methylbutyl 4-aminobenzoate|Isoamyl-4-aminobenzoat|isopentyl4-aminobenzoate|EINECS 253-789-0|Benzoic acid, 4-amino-, 3-methylbutyl ester|3-Methyl-1-butanol 4-aminobenzoate|AI3-05690|1-Butanol, 3-methyl-,1-(4-aminobenzoate)|1-BUTANOL, 3-METHYL-, 1-(4-AMINOBENZOATE)|253-789-0
CAS: 4660-99-5
| Molecular Formula | C12H17NO2 |
|---|---|
| Molecular Weight | 207.12593 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 52.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 207.12593 |
| Monoisotopic Mass | 207.12593 |
| Heavy Atoms | 15 |
| Complexity | 196.0 |
Chemical Identifiers
| CAS Number | 4660-99-5 |
|---|---|
| SMILES | CC(C)CCOC(=O)C1=CC=C(C=C1)N |
| InChIKey | DVPONJRILZFUGU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Heterocyclic Building Blocks (2 patents)
Pharmaceutical Intermediates (10 patents)
Plastic Additives (2 patents)
Polymer Intermediates (1 patents)
Product Overview
Isopentyl 4-aminobenzoate (CAS 4660-99-5), with molecular formula C12H17NO2 and molecular weight 207.12593 g/mol. IUPAC: 3-methylbutyl 4-aminobenzoate.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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