![Benzoic acid, 2-[2-[(3-chlorophenyl)amino]-2-oxoethyl]- structure](/static/products/137/137846-35-6.webp)
Benzoic acid, 2-[2-[(3-chlorophenyl)amino]-2-oxoethyl]-
TL;DR: Benzoic acid, 2-[2-[(3-chlorophenyl)amino]-2-oxoethyl]- (CAS 137846-35-6) is a chemical compound with molecular formula C15H12ClNO3 and molecular weight 289.05057 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[2-(3-chloroanilino)-2-oxoethyl]benzoic acid
Also Known As: 2-[2-(3-chloroanilino)-2-oxoethyl]benzoic acid, Benzoic acid, 2-[2-[(3-chlorophenyl)amino]-2-oxoethyl]-, 2-[(3-chlorophenyl)carbamoylmethyl]benzoic Acid, 2-[2-[3-Chloroanilino]-2-oxoethyl]benzoic acid, 2-{2-[(3-chlorophenyl)amino]-2-oxoethyl}benzoic acid
Technical Specifications
| Molecular Formula | C15H12ClNO3 |
| Molecular Weight | 289.05057 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 289.05057 Da |
| Heavy Atoms | 20 |
| Complexity | 361.0 |
| SMILES | C1=CC=C(C(=C1)CC(=O)NC2=CC(=CC=C2)Cl)C(=O)O |
| InChIKey | XBPLNESDVCWMHC-UHFFFAOYSA-N |
Chemical Property Profile of Benzoic acid, 2-[2-[(3-chlorophenyl)amino]-2-oxoethyl]-
Property Insights of Benzoic acid, 2-[2-[(3-chlorophenyl)amino]-2-oxoethyl]-
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzoic acid, 2-[2-[(3-chlorophenyl)amino]-2-oxoethyl]-. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, 2-[2-[(3-chlorophenyl)amino]-2-oxoethyl]-. Following Lipinski's Rule of Five, Benzoic acid, 2-[2-[(3-chlorophenyl)amino]-2-oxoethyl]- 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
What is the CAS number of Benzoic acid, 2-[2-[(3-chlorophenyl)amino]-2-oxoethyl]-?
The CAS number of Benzoic acid, 2-[2-[(3-chlorophenyl)amino]-2-oxoethyl]- is 137846-35-6.
What is the molecular formula of Benzoic acid, 2-[2-[(3-chlorophenyl)amino]-2-oxoethyl]-?
The molecular formula of Benzoic acid, 2-[2-[(3-chlorophenyl)amino]-2-oxoethyl]- is C15H12ClNO3.
What is the molecular weight of Benzoic acid, 2-[2-[(3-chlorophenyl)amino]-2-oxoethyl]-?
The molecular weight of Benzoic acid, 2-[2-[(3-chlorophenyl)amino]-2-oxoethyl]- is 289.05057 g/mol.
Where can I buy Benzoic acid, 2-[2-[(3-chlorophenyl)amino]-2-oxoethyl]-?
You can request a quote for Benzoic acid, 2-[2-[(3-chlorophenyl)amino]-2-oxoethyl]- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Benzoic acid, 2-[2-[(3-chlorophenyl)amino]-2-oxoethyl]-?
Yes, CoreyChem provides custom synthesis services for Benzoic acid, 2-[2-[(3-chlorophenyl)amino]-2-oxoethyl]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.