乙醯天門冬胺酸
TL;DR: 乙醯天門冬胺酸 (CAS 997-55-7) is a chemical compound with molecular formula C6H9NO5 and molecular weight 175.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
乙醯天門冬胺酸
(2S)-2-acetamidobutanedioic acid
Also Known As: N-Acetyl-L-aspartic acid, N-Acetylaspartate, Acetyl-L-aspartic acid, N-Acetylaspartic acid, Acetylaspartic acid
| Molecular Formula | C6H9NO5 |
|---|---|
| Molecular Weight | 175.05 g/mol |
| LogP | -1.1 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 175.04807 |
| Heavy Atoms | 12 |
| Complexity | 212.0 |
| Melting Point | 137 - 140 °C |
| Solubility | 675 mg/mL |
Chemical Identifiers
| CAS Number | 997-55-7 |
|---|---|
| SMILES | CC(=O)N[C@@H](CC(=O)O)C(=O)O |
| InChIKey | OTCCIMWXFLJLIA-BYPYZUCNSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
乙醯天門冬胺酸 (CAS 997-55-7), with molecular formula C6H9NO5 and molecular weight 175.05 g/mol. IUPAC: (2S)-2-acetamidobutanedioic acid.
Chemical Property Profile of 乙醯天門冬胺酸
Property Insights of 乙醯天門冬胺酸
The XLogP value of -1.1 indicates that 乙醯天門冬胺酸 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 乙醯天門冬胺酸. Following Lipinski's Rule of Five, 乙醯天門冬胺酸 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 乙醯天門冬胺酸?
The CAS number of 乙醯天門冬胺酸 is 997-55-7.
What is the molecular formula of 乙醯天門冬胺酸?
The molecular formula of 乙醯天門冬胺酸 is C6H9NO5.
What is the molecular weight of 乙醯天門冬胺酸?
The molecular weight of 乙醯天門冬胺酸 is 175.05 g/mol.
Where can I buy 乙醯天門冬胺酸?
You can request a quote for 乙醯天門冬胺酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 乙醯天門冬胺酸?
Yes, KEHONG BIO provides custom synthesis services for 乙醯天門冬胺酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.