2-((3-氯苯基)氨基)苯甲酸
TL;DR: 2-((3-氯苯基)氨基)苯甲酸 (CAS 13278-36-9) is a chemical compound with molecular formula C13H10ClNO2 and molecular weight 247.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-((3-氯苯基)氨基)苯甲酸
2-(3-chloroanilino)benzoic acid
Also Known As: 2-((3-Chlorophenyl)amino)benzoic acid, Clofenamic acid, 2-(3-Chloroanilino)benzoic acid, N-(3-Chlorophenyl)anthranilic Acid, 2-[(3-Chlorophenyl)amino]benzoic Acid
| Molecular Formula | C13H10ClNO2 |
|---|---|
| Molecular Weight | 247.04 g/mol |
| LogP | 5.6 |
| Topological Polar Surface Area | 49.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 247.04001 |
| Heavy Atoms | 17 |
| Complexity | 272.0 |
Chemical Identifiers
| CAS Number | 13278-36-9 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)O)NC2=CC(=CC=C2)Cl |
| InChIKey | OVMWPVYEBVFZHM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-((3-氯苯基)氨基)苯甲酸 (CAS 13278-36-9), with molecular formula C13H10ClNO2 and molecular weight 247.04 g/mol. IUPAC: 2-(3-chloroanilino)benzoic acid.
Chemical Property Profile of 2-((3-氯苯基)氨基)苯甲酸
Property Insights of 2-((3-氯苯基)氨基)苯甲酸
The XLogP value of 5.6 indicates that 2-((3-氯苯基)氨基)苯甲酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.3 Ų, 2-((3-氯苯基)氨基)苯甲酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-((3-氯苯基)氨基)苯甲酸 has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-((3-氯苯基)氨基)苯甲酸?
The CAS number of 2-((3-氯苯基)氨基)苯甲酸 is 13278-36-9.
What is the molecular formula of 2-((3-氯苯基)氨基)苯甲酸?
The molecular formula of 2-((3-氯苯基)氨基)苯甲酸 is C13H10ClNO2.
What is the molecular weight of 2-((3-氯苯基)氨基)苯甲酸?
The molecular weight of 2-((3-氯苯基)氨基)苯甲酸 is 247.04 g/mol.
Where can I buy 2-((3-氯苯基)氨基)苯甲酸?
You can request a quote for 2-((3-氯苯基)氨基)苯甲酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((3-氯苯基)氨基)苯甲酸?
Yes, KEHONG BIO provides custom synthesis services for 2-((3-氯苯基)氨基)苯甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.