2-Amino-4-(4-chlorophenyl)-4-oxobutanoic acid
TL;DR: 2-Amino-4-(4-chlorophenyl)-4-oxobutanoic acid (CAS 139084-65-4) 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.
2-amino-4-(4-chlorophenyl)-4-oxobutanoic acid
Also Known As: starbld0024282, 2-amino-4-(4-chlorophenyl)-4-oxobutanoic acid, alpha-Amino-beta-(p-chlorobenzoyl)propionic acid, alpha-Amino-4-chloro-gamma-oxobenzenebutanoic acid, Benzenebutanoic acid, alpha-amino-4-chloro-gamma-oxo-
| Molecular Formula | C10H10ClNO3 |
|---|---|
| Molecular Weight | 227.03 g/mol |
| LogP | 1.3247 |
| Topological Polar Surface Area | 80.39 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 227.03493 |
| Heavy Atoms | 15 |
| Complexity | 374.75882 |
Chemical Identifiers
| CAS Number | 139084-65-4 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)CC(C(=O)O)N)Cl |
Product Overview
2-Amino-4-(4-chlorophenyl)-4-oxobutanoic acid (CAS 139084-65-4), with molecular formula C10H10ClNO3 and molecular weight 227.03 g/mol. IUPAC: 2-amino-4-(4-chlorophenyl)-4-oxobutanoic acid.
Chemical Property Profile of 2-Amino-4-(4-chlorophenyl)-4-oxobutanoic acid
Property Insights of 2-Amino-4-(4-chlorophenyl)-4-oxobutanoic acid
The XLogP value of 1.3247 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Amino-4-(4-chlorophenyl)-4-oxobutanoic acid. The TPSA of 80.39 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Amino-4-(4-chlorophenyl)-4-oxobutanoic acid. Following Lipinski's Rule of Five, 2-Amino-4-(4-chlorophenyl)-4-oxobutanoic acid 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
Frequently Asked Questions
What is the CAS number of 2-Amino-4-(4-chlorophenyl)-4-oxobutanoic acid?
The CAS number of 2-Amino-4-(4-chlorophenyl)-4-oxobutanoic acid is 139084-65-4.
What is the molecular formula of 2-Amino-4-(4-chlorophenyl)-4-oxobutanoic acid?
The molecular formula of 2-Amino-4-(4-chlorophenyl)-4-oxobutanoic acid is C10H10ClNO3.
What is the molecular weight of 2-Amino-4-(4-chlorophenyl)-4-oxobutanoic acid?
The molecular weight of 2-Amino-4-(4-chlorophenyl)-4-oxobutanoic acid is 227.03 g/mol.
Where can I buy 2-Amino-4-(4-chlorophenyl)-4-oxobutanoic acid?
You can request a quote for 2-Amino-4-(4-chlorophenyl)-4-oxobutanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Amino-4-(4-chlorophenyl)-4-oxobutanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Amino-4-(4-chlorophenyl)-4-oxobutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.