Benzoic acid, 2-[(2-chloroacetyl)phenylamino]-
TL;DR: Benzoic acid, 2-[(2-chloroacetyl)phenylamino]- (CAS 3606-15-3) is a chemical compound with molecular formula C15H12ClNO3 and molecular weight 289.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(N-(2-chloroacetyl)anilino)benzoic acid
Also Known As: Benzoic acid, 2-[(2-chloroacetyl)phenylamino]-, 2-(N-(2-chloroacetyl)anilino)benzoic acid, 2-[(2-Chloroacetyl)phenylamino]benzoic acid, 2-[(Chloroacetyl)(phenyl)amino]benzoic acid, 2-(2-chloro-N-phenylacetylamino)benzoic acid
| Molecular Formula | C15H12ClNO3 |
|---|---|
| Molecular Weight | 289.05 g/mol |
| LogP | 3.2883 |
| Topological Polar Surface Area | 57.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 289.05057 |
| Heavy Atoms | 20 |
| Complexity | 628.0256 |
Chemical Identifiers
| CAS Number | 3606-15-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)N(C2=CC=CC=C2C(=O)O)C(=O)CCl |
Product Overview
Benzoic acid, 2-[(2-chloroacetyl)phenylamino]- (CAS 3606-15-3), with molecular formula C15H12ClNO3 and molecular weight 289.05 g/mol. IUPAC: 2-(N-(2-chloroacetyl)anilino)benzoic acid.
Chemical Property Profile of Benzoic acid, 2-[(2-chloroacetyl)phenylamino]-
Property Insights of Benzoic acid, 2-[(2-chloroacetyl)phenylamino]-
The XLogP value of 3.2883 indicates that Benzoic acid, 2-[(2-chloroacetyl)phenylamino]- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.61 Ų, Benzoic acid, 2-[(2-chloroacetyl)phenylamino]- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzoic acid, 2-[(2-chloroacetyl)phenylamino]- has 1 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 Benzoic acid, 2-[(2-chloroacetyl)phenylamino]-?
The CAS number of Benzoic acid, 2-[(2-chloroacetyl)phenylamino]- is 3606-15-3.
What is the molecular formula of Benzoic acid, 2-[(2-chloroacetyl)phenylamino]-?
The molecular formula of Benzoic acid, 2-[(2-chloroacetyl)phenylamino]- is C15H12ClNO3.
What is the molecular weight of Benzoic acid, 2-[(2-chloroacetyl)phenylamino]-?
The molecular weight of Benzoic acid, 2-[(2-chloroacetyl)phenylamino]- is 289.05 g/mol.
Where can I buy Benzoic acid, 2-[(2-chloroacetyl)phenylamino]-?
You can request a quote for Benzoic acid, 2-[(2-chloroacetyl)phenylamino]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 2-[(2-chloroacetyl)phenylamino]-?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 2-[(2-chloroacetyl)phenylamino]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.