Chloroac-Asp-OH
TL;DR: Chloroac-Asp-OH (CAS 67036-33-3) is a chemical compound with molecular formula C6H8ClNO5 and molecular weight 209.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-[(2-chloroacetyl)amino]butanedioic acid
Also Known As: Chloroac-Asp-OH, Chloracetyl L-asparaginsaure, N-(2-Chloroacetyl)-L-aspartic acid, N-(Chloroacetyl)-L-aspartic acid, (2S)-2-(2-chloroacetamido)butanedioic acid
| Molecular Formula | C6H8ClNO5 |
|---|---|
| Molecular Weight | 209.01 g/mol |
| LogP | -0.7307 |
| Topological Polar Surface Area | 103.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 209.0091 |
| Heavy Atoms | 13 |
| Complexity | 229.0645 |
Chemical Identifiers
| CAS Number | 67036-33-3 |
|---|---|
| SMILES | C([C@@H](C(=O)O)NC(=O)CCl)C(=O)O |
Product Overview
Chloroac-Asp-OH (CAS 67036-33-3), with molecular formula C6H8ClNO5 and molecular weight 209.01 g/mol. IUPAC: (2S)-2-[(2-chloroacetyl)amino]butanedioic acid.
Chemical Property Profile of Chloroac-Asp-OH
Property Insights of Chloroac-Asp-OH
The XLogP value of -0.7307 indicates that Chloroac-Asp-OH is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 103.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Chloroac-Asp-OH. Following Lipinski's Rule of Five, Chloroac-Asp-OH has 3 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 Chloroac-Asp-OH?
The CAS number of Chloroac-Asp-OH is 67036-33-3.
What is the molecular formula of Chloroac-Asp-OH?
The molecular formula of Chloroac-Asp-OH is C6H8ClNO5.
What is the molecular weight of Chloroac-Asp-OH?
The molecular weight of Chloroac-Asp-OH is 209.01 g/mol.
Where can I buy Chloroac-Asp-OH?
You can request a quote for Chloroac-Asp-OH directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Chloroac-Asp-OH?
Yes, KEHONG BIO provides custom synthesis services for Chloroac-Asp-OH and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.