![(2S)-2-[(chloroacetyl)amino]butanedioic acid structure](/static/products/6732/67324-95-2.webp)
(2S)-2-[(chloroacetyl)amino]butanedioic acid
TL;DR: (2S)-2-[(chloroacetyl)amino]butanedioic acid (CAS 67324-95-2) 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.
2-[(2-chloroacetyl)amino]butanedioic acid
Also Known As: Chloroac-Asp-OH, N-chloroacetyl-DL-aspartic acid, 2-[(2-chloroacetyl)amino]succinic acid, (2-Chloroacetyl)-L-aspartic acid, 2-(2-chloroacetamido)butanedioic acid
| Molecular Formula | C6H8ClNO5 |
|---|---|
| Molecular Weight | 209.01 g/mol |
| LogP | -0.7 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 209.0091 |
| Heavy Atoms | 13 |
| Complexity | 229.0 |
Chemical Identifiers
| CAS Number | 67324-95-2 |
|---|---|
| SMILES | C(C(C(=O)O)NC(=O)CCl)C(=O)O |
| InChIKey | COXKWXFZCRVVQB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(2S)-2-[(chloroacetyl)amino]butanedioic acid (CAS 67324-95-2), with molecular formula C6H8ClNO5 and molecular weight 209.01 g/mol. IUPAC: 2-[(2-chloroacetyl)amino]butanedioic acid.
Chemical Property Profile of (2S)-2-[(chloroacetyl)amino]butanedioic acid
Property Insights of (2S)-2-[(chloroacetyl)amino]butanedioic acid
The XLogP value of -0.7 indicates that (2S)-2-[(chloroacetyl)amino]butanedioic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (2S)-2-[(chloroacetyl)amino]butanedioic acid. Following Lipinski's Rule of Five, (2S)-2-[(chloroacetyl)amino]butanedioic acid has 3 hydrogen bond donor(s) and 5 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 (2S)-2-[(chloroacetyl)amino]butanedioic acid?
The CAS number of (2S)-2-[(chloroacetyl)amino]butanedioic acid is 67324-95-2.
What is the molecular formula of (2S)-2-[(chloroacetyl)amino]butanedioic acid?
The molecular formula of (2S)-2-[(chloroacetyl)amino]butanedioic acid is C6H8ClNO5.
What is the molecular weight of (2S)-2-[(chloroacetyl)amino]butanedioic acid?
The molecular weight of (2S)-2-[(chloroacetyl)amino]butanedioic acid is 209.01 g/mol.
Where can I buy (2S)-2-[(chloroacetyl)amino]butanedioic acid?
You can request a quote for (2S)-2-[(chloroacetyl)amino]butanedioic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2S)-2-[(chloroacetyl)amino]butanedioic acid?
Yes, KEHONG BIO provides custom synthesis services for (2S)-2-[(chloroacetyl)amino]butanedioic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.