methyl D-alaninate
TL;DR: methyl D-alaninate (CAS 21705-13-5) is a chemical compound with molecular formula C4H9NO2 and molecular weight 103.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (2R)-2-aminopropanoate
Also Known As: Methyl D-alaninate, methyl (2R)-2-aminopropanoate, methylD-alaninate, D-Alanine methyl, D-ALANINE METHYL ESTER
| Molecular Formula | C4H9NO2 |
|---|---|
| Molecular Weight | 103.06 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 52.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 103.06333 |
| Heavy Atoms | 7 |
| Complexity | 72.0 |
Chemical Identifiers
| CAS Number | 21705-13-5 |
|---|---|
| SMILES | C[C@H](C(=O)OC)N |
| InChIKey | DWKPPFQULDPWHX-GSVOUGTGSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
methyl D-alaninate (CAS 21705-13-5), with molecular formula C4H9NO2 and molecular weight 103.06 g/mol. IUPAC: methyl (2R)-2-aminopropanoate.
Chemical Property Profile of methyl D-alaninate
Property Insights of methyl D-alaninate
The XLogP value of -0.4 indicates that methyl D-alaninate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 52.3 Ų, methyl D-alaninate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, methyl D-alaninate has 1 hydrogen bond donor(s) and 3 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 methyl D-alaninate?
The CAS number of methyl D-alaninate is 21705-13-5.
What is the molecular formula of methyl D-alaninate?
The molecular formula of methyl D-alaninate is C4H9NO2.
What is the molecular weight of methyl D-alaninate?
The molecular weight of methyl D-alaninate is 103.06 g/mol.
Where can I buy methyl D-alaninate?
You can request a quote for methyl D-alaninate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl D-alaninate?
Yes, KEHONG BIO provides custom synthesis services for methyl D-alaninate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.