Benzoic acid, 4-amino-, pentyl ester
pentyl 4-aminobenzoate
CAS: 13110-37-7
| Molecular Formula | C12H17NO2 |
|---|---|
| Molecular Weight | 207.27 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 52.3 A2 |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 207.12593 |
| Heavy Atoms | 15 |
| Complexity | 186.0 |
Chemical Identifiers
| CAS Number | 13110-37-7 |
|---|---|
| SMILES | CCCCCOC(=O)C1=CC=C(C=C1)N |
| InChIKey | VKYWCHMXHQTCJQ-UHFFFAOYSA-N |
📖 Product Overview
Benzoic acid, 4-amino-, pentyl ester (CAS: 13110-37-7) is a chemical compound with molecular formula C12H17NO2 and molecular weight 207.27 g/mol. Its IUPAC systematic name is pentyl 4-aminobenzoate.
VKYWCHMXHQTCJQ-UHFFFAOYSA-N.
SMILES: CCCCCOC(=O)C1=CC=C(C=C1)N.
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.
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📚 Academic Support
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