4-Chlorothreonine
TL;DR: 4-Chlorothreonine (CAS 142698-80-4) is a chemical compound with molecular formula C(C(C(C(=O)O)N)O)Cl and molecular weight 153.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-4-chloro-3-hydroxybutanoic acid
Also Known As: 4-Chlorothreonine, D-Threonine, 4-chloro-, 4-Chloro-D-threonine, 4-Chloro-DL-threonine, L-Threonine, 4-chloro-
| Molecular Formula | C(C(C(C(=O)O)N)O)Cl |
|---|---|
| Molecular Weight | 153.02 g/mol |
| LogP | -2.7 |
| Topological Polar Surface Area | 83.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 153.01927 |
| Heavy Atoms | 9 |
| Complexity | 108.0 |
Chemical Identifiers
| CAS Number | 142698-80-4 |
|---|---|
| SMILES | C(C(C(C(=O)O)N)O)Cl |
| InChIKey | CETUIFTXYGHITB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Chlorothreonine (CAS 142698-80-4), with molecular formula C(C(C(C(=O)O)N)O)Cl and molecular weight 153.02 g/mol. IUPAC: 2-amino-4-chloro-3-hydroxybutanoic acid.
Chemical Property Profile of 4-Chlorothreonine
Property Insights of 4-Chlorothreonine
The XLogP value of -2.7 indicates that 4-Chlorothreonine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 83.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Chlorothreonine. Following Lipinski's Rule of Five, 4-Chlorothreonine has 3 hydrogen bond donor(s) and 4 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 4-Chlorothreonine?
The CAS number of 4-Chlorothreonine is 142698-80-4.
What is the molecular formula of 4-Chlorothreonine?
The molecular formula of 4-Chlorothreonine is C(C(C(C(=O)O)N)O)Cl.
What is the molecular weight of 4-Chlorothreonine?
The molecular weight of 4-Chlorothreonine is 153.02 g/mol.
Where can I buy 4-Chlorothreonine?
You can request a quote for 4-Chlorothreonine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chlorothreonine?
Yes, KEHONG BIO provides custom synthesis services for 4-Chlorothreonine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.