3-Hydroxy-4-methylpentanenitrile
TL;DR: 3-Hydroxy-4-methylpentanenitrile (CAS 60234-37-9) is a chemical compound with molecular formula C6H11NO and molecular weight 113.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-hydroxy-4-methylpentanenitrile
Also Known As: 3-hydroxy-4-methylpentanenitrile, Pentanenitrile,3-hydroxy-4-methyl, (RS)-3-hydroxy-4-methylpentanenitrile, Pentanenitrile, 3-hydroxy-4-methyl-, RefChem:279870
| Molecular Formula | C6H11NO |
|---|---|
| Molecular Weight | 113.08 g/mol |
| LogP | 0.91698 |
| Topological Polar Surface Area | 44.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 113.08406 |
| Heavy Atoms | 8 |
| Complexity | 93.19188 |
Chemical Identifiers
| CAS Number | 60234-37-9 |
|---|---|
| SMILES | CC(C)C(CC#N)O |
Product Overview
3-Hydroxy-4-methylpentanenitrile (CAS 60234-37-9), with molecular formula C6H11NO and molecular weight 113.08 g/mol. IUPAC: 3-hydroxy-4-methylpentanenitrile.
Chemical Property Profile of 3-Hydroxy-4-methylpentanenitrile
Property Insights of 3-Hydroxy-4-methylpentanenitrile
The XLogP value of 0.91698 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Hydroxy-4-methylpentanenitrile. With a topological polar surface area (TPSA) of 44.02 Ų, 3-Hydroxy-4-methylpentanenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Hydroxy-4-methylpentanenitrile has 1 hydrogen bond donor(s) and 2 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-Hydroxy-4-methylpentanenitrile?
The CAS number of 3-Hydroxy-4-methylpentanenitrile is 60234-37-9.
What is the molecular formula of 3-Hydroxy-4-methylpentanenitrile?
The molecular formula of 3-Hydroxy-4-methylpentanenitrile is C6H11NO.
What is the molecular weight of 3-Hydroxy-4-methylpentanenitrile?
The molecular weight of 3-Hydroxy-4-methylpentanenitrile is 113.08 g/mol.
Where can I buy 3-Hydroxy-4-methylpentanenitrile?
You can request a quote for 3-Hydroxy-4-methylpentanenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Hydroxy-4-methylpentanenitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-Hydroxy-4-methylpentanenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.