Chloroacetyl-L-valine
TL;DR: Chloroacetyl-L-valine (CAS 41230-51-7) is a chemical compound with molecular formula C7H12ClNO3 and molecular weight 193.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-[(2-chloroacetyl)amino]-3-methylbutanoic acid
Also Known As: N-Chloroacetyl-l-valine, Chloroacetyl-L-valine, Chloroacetyl-dl-valine, Chloroacetyl-L-Val-OH, N-Chloroacetyl-DL-valine
| Molecular Formula | C7H12ClNO3 |
|---|---|
| Molecular Weight | 193.05 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 193.05057 |
| Heavy Atoms | 12 |
| Complexity | 181.0 |
Chemical Identifiers
| CAS Number | 41230-51-7 |
|---|---|
| SMILES | CC(C)[C@@H](C(=O)O)NC(=O)CCl |
| InChIKey | LJRISAYPKJORFZ-LURJTMIESA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Chloroacetyl-L-valine (CAS 41230-51-7), with molecular formula C7H12ClNO3 and molecular weight 193.05 g/mol. IUPAC: (2S)-2-[(2-chloroacetyl)amino]-3-methylbutanoic acid.
Chemical Property Profile of Chloroacetyl-L-valine
Property Insights of Chloroacetyl-L-valine
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Chloroacetyl-L-valine. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Chloroacetyl-L-valine. Following Lipinski's Rule of Five, Chloroacetyl-L-valine 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 Chloroacetyl-L-valine?
The CAS number of Chloroacetyl-L-valine is 41230-51-7.
What is the molecular formula of Chloroacetyl-L-valine?
The molecular formula of Chloroacetyl-L-valine is C7H12ClNO3.
What is the molecular weight of Chloroacetyl-L-valine?
The molecular weight of Chloroacetyl-L-valine is 193.05 g/mol.
Where can I buy Chloroacetyl-L-valine?
You can request a quote for Chloroacetyl-L-valine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Chloroacetyl-L-valine?
Yes, KEHONG BIO provides custom synthesis services for Chloroacetyl-L-valine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.