3-Methoxyvaline
TL;DR: 3-Methoxyvaline (CAS 21580-44-9) is a chemical compound with molecular formula C6H13NO3 and molecular weight 147.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-3-methoxy-3-methylbutanoic acid
Also Known As: 3-methoxyvaline, 2-amino-3-methoxy-3-methylbutanoic acid, 3-Methoxy-DL-valine, 3-Methoxyvaline (H-Val(3-OMe)-OH), 2-amino-3-methoxy-3-methyl-butanoic acid
| Molecular Formula | C6H13NO3 |
|---|---|
| Molecular Weight | 147.09 g/mol |
| LogP | -2.9 |
| Topological Polar Surface Area | 72.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 147.08954 |
| Heavy Atoms | 10 |
| Complexity | 133.0 |
Chemical Identifiers
| CAS Number | 21580-44-9 |
|---|---|
| SMILES | CC(C)(C(C(=O)O)N)OC |
| InChIKey | RDBBJCUJCNMAAF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Methoxyvaline (CAS 21580-44-9), with molecular formula C6H13NO3 and molecular weight 147.09 g/mol. IUPAC: 2-amino-3-methoxy-3-methylbutanoic acid.
Chemical Property Profile of 3-Methoxyvaline
Property Insights of 3-Methoxyvaline
The XLogP value of -2.9 indicates that 3-Methoxyvaline is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 72.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Methoxyvaline. Following Lipinski's Rule of Five, 3-Methoxyvaline has 2 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 3-Methoxyvaline?
The CAS number of 3-Methoxyvaline is 21580-44-9.
What is the molecular formula of 3-Methoxyvaline?
The molecular formula of 3-Methoxyvaline is C6H13NO3.
What is the molecular weight of 3-Methoxyvaline?
The molecular weight of 3-Methoxyvaline is 147.09 g/mol.
Where can I buy 3-Methoxyvaline?
You can request a quote for 3-Methoxyvaline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methoxyvaline?
Yes, KEHONG BIO provides custom synthesis services for 3-Methoxyvaline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.