1-Phenylmethanamine benzoate(1:1)
TL;DR: 1-Phenylmethanamine benzoate(1:1) (CAS 34403-62-8) is a chemical compound with molecular formula C14H15NO2 and molecular weight 229.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzoic acid;phenylmethanamine
Also Known As: 1-phenylmethanamine benzoate(1:1), benzoic acid,phenylmethanamine, benzoic acid; phenylmethanamine, Benzoic acid--1-phenylmethanamine (1/1)
| Molecular Formula | C14H15NO2 |
|---|---|
| Molecular Weight | 229.11 g/mol |
| LogP | 2.5301 |
| Topological Polar Surface Area | 63.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 229.11028 |
| Heavy Atoms | 17 |
| Complexity | 159.0 |
Chemical Identifiers
| CAS Number | 34403-62-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN.C1=CC=C(C=C1)C(=O)O |
| InChIKey | YAQDPZIUXFPKJQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Phenylmethanamine benzoate(1:1) (CAS 34403-62-8), with molecular formula C14H15NO2 and molecular weight 229.11 g/mol. IUPAC: benzoic acid;phenylmethanamine.
Chemical Property Profile of 1-Phenylmethanamine benzoate(1:1)
Property Insights of 1-Phenylmethanamine benzoate(1:1)
The XLogP value of 2.5301 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Phenylmethanamine benzoate(1:1). The TPSA of 63.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Phenylmethanamine benzoate(1:1). Following Lipinski's Rule of Five, 1-Phenylmethanamine benzoate(1:1) has 2 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 1-Phenylmethanamine benzoate(1:1)?
The CAS number of 1-Phenylmethanamine benzoate(1:1) is 34403-62-8.
What is the molecular formula of 1-Phenylmethanamine benzoate(1:1)?
The molecular formula of 1-Phenylmethanamine benzoate(1:1) is C14H15NO2.
What is the molecular weight of 1-Phenylmethanamine benzoate(1:1)?
The molecular weight of 1-Phenylmethanamine benzoate(1:1) is 229.11 g/mol.
Where can I buy 1-Phenylmethanamine benzoate(1:1)?
You can request a quote for 1-Phenylmethanamine benzoate(1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Phenylmethanamine benzoate(1:1)?
Yes, KEHONG BIO provides custom synthesis services for 1-Phenylmethanamine benzoate(1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.