3-(benzylamino)benzoic Acid
TL;DR: 3-(benzylamino)benzoic Acid (CAS 63760-14-5) is a chemical compound with molecular formula C14H13NO2 and molecular weight 227.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(benzylamino)benzoic acid
Also Known As: 3-(benzylamino)benzoic Acid, 3-Benzylamino-benzoic acid, 3-[(Phenylmethyl)amino]benzoic acid
| Molecular Formula | C14H13NO2 |
|---|---|
| Molecular Weight | 227.09 g/mol |
| LogP | 2.9969 |
| Topological Polar Surface Area | 49.33 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 227.09464 |
| Heavy Atoms | 17 |
| Complexity | 508.64047 |
Chemical Identifiers
| CAS Number | 63760-14-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)CNC2=CC=CC(=C2)C(=O)O |
Product Overview
3-(benzylamino)benzoic Acid (CAS 63760-14-5), with molecular formula C14H13NO2 and molecular weight 227.09 g/mol. IUPAC: 3-(benzylamino)benzoic acid.
Chemical Property Profile of 3-(benzylamino)benzoic Acid
Property Insights of 3-(benzylamino)benzoic Acid
The XLogP value of 2.9969 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(benzylamino)benzoic Acid. With a topological polar surface area (TPSA) of 49.33 Ų, 3-(benzylamino)benzoic Acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(benzylamino)benzoic Acid has 2 hydrogen bond donor(s) and 2 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 3-(benzylamino)benzoic Acid?
The CAS number of 3-(benzylamino)benzoic Acid is 63760-14-5.
What is the molecular formula of 3-(benzylamino)benzoic Acid?
The molecular formula of 3-(benzylamino)benzoic Acid is C14H13NO2.
What is the molecular weight of 3-(benzylamino)benzoic Acid?
The molecular weight of 3-(benzylamino)benzoic Acid is 227.09 g/mol.
Where can I buy 3-(benzylamino)benzoic Acid?
You can request a quote for 3-(benzylamino)benzoic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(benzylamino)benzoic Acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(benzylamino)benzoic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.