Dimethyl DL-aspartate
TL;DR: Dimethyl DL-aspartate (CAS 32213-95-9) is a chemical compound with molecular formula C6H11NO4 and molecular weight 161.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 2-aminobutanedioate
Also Known As: Dimethyl DL-aspartate, dimethyl 2-aminobutanedioate, dimethyl aspartate, H-Asp(ome)-OMe HCl, Asparaginsauredimethylester
| Molecular Formula | C6H11NO4 |
|---|---|
| Molecular Weight | 161.07 g/mol |
| LogP | -0.9 |
| Topological Polar Surface Area | 78.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 161.0688 |
| Heavy Atoms | 11 |
| Complexity | 157.0 |
Chemical Identifiers
| CAS Number | 32213-95-9 |
|---|---|
| SMILES | COC(=O)CC(C(=O)OC)N |
| InChIKey | BYHXBBOSJKPUJL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dimethyl DL-aspartate (CAS 32213-95-9), with molecular formula C6H11NO4 and molecular weight 161.07 g/mol. IUPAC: dimethyl 2-aminobutanedioate.
Chemical Property Profile of Dimethyl DL-aspartate
Property Insights of Dimethyl DL-aspartate
The XLogP value of -0.9 indicates that Dimethyl DL-aspartate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 78.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethyl DL-aspartate. Following Lipinski's Rule of Five, Dimethyl DL-aspartate has 1 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 Dimethyl DL-aspartate?
The CAS number of Dimethyl DL-aspartate is 32213-95-9.
What is the molecular formula of Dimethyl DL-aspartate?
The molecular formula of Dimethyl DL-aspartate is C6H11NO4.
What is the molecular weight of Dimethyl DL-aspartate?
The molecular weight of Dimethyl DL-aspartate is 161.07 g/mol.
Where can I buy Dimethyl DL-aspartate?
You can request a quote for Dimethyl DL-aspartate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl DL-aspartate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl DL-aspartate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.