methyl (3S)-3-hydroxy-2-methylidenebutanoate
TL;DR: methyl (3S)-3-hydroxy-2-methylidenebutanoate (CAS 20026-40-8) is a chemical compound with molecular formula C6H10O3 and molecular weight 130.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (3S)-3-hydroxy-2-methylidenebutanoate
Also Known As: methyl 3-hydroxy-2-methylenebutanoate, methyl (3S)-3-hydroxy-2-methylidenebutanoate, 2-[(S)-1-Hydroxyethyl]acrylic acid methyl ester, (3S)-3-Hydroxy-2-methylenebutyric acid methyl ester
| Molecular Formula | C6H10O3 |
|---|---|
| Molecular Weight | 130.06 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 130.06299 |
| Heavy Atoms | 9 |
| Complexity | 128.0 |
Chemical Identifiers
| CAS Number | 20026-40-8 |
|---|---|
| SMILES | C[C@@H](C(=C)C(=O)OC)O |
| InChIKey | VLCAYQIMSMPEBW-YFKPBYRVSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
methyl (3S)-3-hydroxy-2-methylidenebutanoate (CAS 20026-40-8), with molecular formula C6H10O3 and molecular weight 130.06 g/mol. IUPAC: methyl (3S)-3-hydroxy-2-methylidenebutanoate.
Chemical Property Profile of methyl (3S)-3-hydroxy-2-methylidenebutanoate
Property Insights of methyl (3S)-3-hydroxy-2-methylidenebutanoate
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl (3S)-3-hydroxy-2-methylidenebutanoate. With a topological polar surface area (TPSA) of 46.5 Ų, methyl (3S)-3-hydroxy-2-methylidenebutanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, methyl (3S)-3-hydroxy-2-methylidenebutanoate 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 (3S)-3-hydroxy-2-methylidenebutanoate?
The CAS number of methyl (3S)-3-hydroxy-2-methylidenebutanoate is 20026-40-8.
What is the molecular formula of methyl (3S)-3-hydroxy-2-methylidenebutanoate?
The molecular formula of methyl (3S)-3-hydroxy-2-methylidenebutanoate is C6H10O3.
What is the molecular weight of methyl (3S)-3-hydroxy-2-methylidenebutanoate?
The molecular weight of methyl (3S)-3-hydroxy-2-methylidenebutanoate is 130.06 g/mol.
Where can I buy methyl (3S)-3-hydroxy-2-methylidenebutanoate?
You can request a quote for methyl (3S)-3-hydroxy-2-methylidenebutanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl (3S)-3-hydroxy-2-methylidenebutanoate?
Yes, KEHONG BIO provides custom synthesis services for methyl (3S)-3-hydroxy-2-methylidenebutanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.