DL-threo-beta-Hydroxyaspartic acid
TL;DR: DL-threo-beta-Hydroxyaspartic acid (CAS 1860-87-3) is a chemical compound with molecular formula C4H7NO5 and molecular weight 149.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3S)-2-amino-3-hydroxybutanedioic acid
Also Known As: DL-threo-beta-Hydroxyaspartic acid, L-threo-3-Hydroxyaspartic acid, beta-Hydroxyaspartic acid, (3S)-3-hydroxy-L-aspartic acid, L-(-)-threo-3-Hydroxyaspartic acid
| Molecular Formula | C4H7NO5 |
|---|---|
| Molecular Weight | 149.03 g/mol |
| LogP | -4.4 |
| Topological Polar Surface Area | 121.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 149.03242 |
| Heavy Atoms | 10 |
| Complexity | 156.0 |
Chemical Identifiers
| CAS Number | 1860-87-3 |
|---|---|
| SMILES | [C@H]([C@@H](C(=O)O)O)(C(=O)O)N |
| InChIKey | YYLQUHNPNCGKJQ-LWMBPPNESA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
DL-threo-beta-Hydroxyaspartic acid (CAS 1860-87-3), with molecular formula C4H7NO5 and molecular weight 149.03 g/mol. IUPAC: (2S,3S)-2-amino-3-hydroxybutanedioic acid.
Chemical Property Profile of DL-threo-beta-Hydroxyaspartic acid
Property Insights of DL-threo-beta-Hydroxyaspartic acid
The XLogP value of -4.4 indicates that DL-threo-beta-Hydroxyaspartic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 121.0 Ų falls within the moderate polarity range, balancing permeability and solubility for DL-threo-beta-Hydroxyaspartic acid. Following Lipinski's Rule of Five, DL-threo-beta-Hydroxyaspartic acid has 4 hydrogen bond donor(s) and 6 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 DL-threo-beta-Hydroxyaspartic acid?
The CAS number of DL-threo-beta-Hydroxyaspartic acid is 1860-87-3.
What is the molecular formula of DL-threo-beta-Hydroxyaspartic acid?
The molecular formula of DL-threo-beta-Hydroxyaspartic acid is C4H7NO5.
What is the molecular weight of DL-threo-beta-Hydroxyaspartic acid?
The molecular weight of DL-threo-beta-Hydroxyaspartic acid is 149.03 g/mol.
Where can I buy DL-threo-beta-Hydroxyaspartic acid?
You can request a quote for DL-threo-beta-Hydroxyaspartic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for DL-threo-beta-Hydroxyaspartic acid?
Yes, KEHONG BIO provides custom synthesis services for DL-threo-beta-Hydroxyaspartic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.