(S)-2-methylbutyronitrile
TL;DR: (S)-2-methylbutyronitrile (CAS 25570-03-0) is a chemical compound with molecular formula C5H9N and molecular weight 83.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-methylbutanenitrile
Also Known As: (S)-(+)-2-Methylbutyronitrile, (2S)-2-methylbutanenitrile, (S)-2-methylbutyronitrile, (S)-2-cyanobutane, (S)-2-Methylbutanenitrile
| Molecular Formula | C5H9N |
|---|---|
| Molecular Weight | 83.07 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 23.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 83.0735 |
| Heavy Atoms | 6 |
| Complexity | 67.0 |
Chemical Identifiers
| CAS Number | 25570-03-0 |
|---|---|
| SMILES | CC[C@H](C)C#N |
| InChIKey | RCEJCSULJQNRQQ-YFKPBYRVSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(S)-2-methylbutyronitrile (CAS 25570-03-0), with molecular formula C5H9N and molecular weight 83.07 g/mol. IUPAC: (2S)-2-methylbutanenitrile.
Chemical Property Profile of (S)-2-methylbutyronitrile
Property Insights of (S)-2-methylbutyronitrile
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-2-methylbutyronitrile. With a topological polar surface area (TPSA) of 23.8 Ų, (S)-2-methylbutyronitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (S)-2-methylbutyronitrile has 0 hydrogen bond donor(s) and 1 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 (S)-2-methylbutyronitrile?
The CAS number of (S)-2-methylbutyronitrile is 25570-03-0.
What is the molecular formula of (S)-2-methylbutyronitrile?
The molecular formula of (S)-2-methylbutyronitrile is C5H9N.
What is the molecular weight of (S)-2-methylbutyronitrile?
The molecular weight of (S)-2-methylbutyronitrile is 83.07 g/mol.
Where can I buy (S)-2-methylbutyronitrile?
You can request a quote for (S)-2-methylbutyronitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S)-2-methylbutyronitrile?
Yes, KEHONG BIO provides custom synthesis services for (S)-2-methylbutyronitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.