N-Methyl-4-(2-chloroacetamido)benzoic acid
TL;DR: N-Methyl-4-(2-chloroacetamido)benzoic acid (CAS 147149-44-8) is a chemical compound with molecular formula C10H10ClNO3 and molecular weight 227.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(2-chloroacetyl)-methylamino]benzoic acid
Also Known As: 4-(2-Chloro-N-methylacetamido)benzoic acid, N-METHYL-4-(2-CHLOROACETAMIDO)BENZOIC ACID, 4-[(2-chloroacetyl)-methylamino]benzoic acid, 4-(2-Chloro-N-methylacetamido)benzoicacid, 4-[(2-chloroacetyl)-methyl-amino]benzoic Acid
| Molecular Formula | C10H10ClNO3 |
|---|---|
| Molecular Weight | 227.03 g/mol |
| LogP | 1.5864 |
| Topological Polar Surface Area | 57.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 227.03493 |
| Heavy Atoms | 15 |
| Complexity | 374.75882 |
Chemical Identifiers
| CAS Number | 147149-44-8 |
|---|---|
| SMILES | CN(C1=CC=C(C=C1)C(=O)O)C(=O)CCl |
Product Overview
N-Methyl-4-(2-chloroacetamido)benzoic acid (CAS 147149-44-8), with molecular formula C10H10ClNO3 and molecular weight 227.03 g/mol. IUPAC: 4-[(2-chloroacetyl)-methylamino]benzoic acid.
Chemical Property Profile of N-Methyl-4-(2-chloroacetamido)benzoic acid
Property Insights of N-Methyl-4-(2-chloroacetamido)benzoic acid
The XLogP value of 1.5864 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Methyl-4-(2-chloroacetamido)benzoic acid. With a topological polar surface area (TPSA) of 57.61 Ų, N-Methyl-4-(2-chloroacetamido)benzoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Methyl-4-(2-chloroacetamido)benzoic acid 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 N-Methyl-4-(2-chloroacetamido)benzoic acid?
The CAS number of N-Methyl-4-(2-chloroacetamido)benzoic acid is 147149-44-8.
What is the molecular formula of N-Methyl-4-(2-chloroacetamido)benzoic acid?
The molecular formula of N-Methyl-4-(2-chloroacetamido)benzoic acid is C10H10ClNO3.
What is the molecular weight of N-Methyl-4-(2-chloroacetamido)benzoic acid?
The molecular weight of N-Methyl-4-(2-chloroacetamido)benzoic acid is 227.03 g/mol.
Where can I buy N-Methyl-4-(2-chloroacetamido)benzoic acid?
You can request a quote for N-Methyl-4-(2-chloroacetamido)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Methyl-4-(2-chloroacetamido)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for N-Methyl-4-(2-chloroacetamido)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.