Heptyl p-aminobenzoate
TL;DR: Heptyl p-aminobenzoate (CAS 14309-40-1) is a chemical compound with molecular formula C14H21NO2 and molecular weight 235.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
heptyl 4-aminobenzoate
Also Known As: heptyl 4-aminobenzoate, HEPTYL P-AMINOBENZOATE, heptyl4-aminobenzoate, 4-Aminobenzoic acid heptyl ester, Benzoic acid, 4-amino-, heptyl ester
| Molecular Formula | C14H21NO2 |
|---|---|
| Molecular Weight | 235.16 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 52.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 235.15723 |
| Heavy Atoms | 17 |
| Complexity | 210.0 |
Chemical Identifiers
| CAS Number | 14309-40-1 |
|---|---|
| SMILES | CCCCCCCOC(=O)C1=CC=C(C=C1)N |
| InChIKey | IAHJVNSZPMIREM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Heptyl p-aminobenzoate (CAS 14309-40-1), with molecular formula C14H21NO2 and molecular weight 235.16 g/mol. IUPAC: heptyl 4-aminobenzoate.
Chemical Property Profile of Heptyl p-aminobenzoate
Property Insights of Heptyl p-aminobenzoate
The XLogP value of 4.5 indicates that Heptyl p-aminobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.3 Ų, Heptyl p-aminobenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Heptyl p-aminobenzoate has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Heptyl p-aminobenzoate?
The CAS number of Heptyl p-aminobenzoate is 14309-40-1.
What is the molecular formula of Heptyl p-aminobenzoate?
The molecular formula of Heptyl p-aminobenzoate is C14H21NO2.
What is the molecular weight of Heptyl p-aminobenzoate?
The molecular weight of Heptyl p-aminobenzoate is 235.16 g/mol.
Where can I buy Heptyl p-aminobenzoate?
You can request a quote for Heptyl p-aminobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Heptyl p-aminobenzoate?
Yes, KEHONG BIO provides custom synthesis services for Heptyl p-aminobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.