2-Methoxypropanenitrile
TL;DR: 2-Methoxypropanenitrile (CAS 26856-69-9) is a chemical compound with molecular formula C4H7NO and molecular weight 85.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methoxypropanenitrile
Also Known As: 2-methoxypropanenitrile, methoxypropionitrile, 3-Methoxypropionitrile, Propanenitrile, methoxy-, Propanenitrile, 2-methoxy-
| Molecular Formula | C4H7NO |
|---|---|
| Molecular Weight | 85.05 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 33.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 85.052765 |
| Heavy Atoms | 6 |
| Complexity | 70.0 |
Chemical Identifiers
| CAS Number | 26856-69-9 |
|---|---|
| SMILES | CC(C#N)OC |
| InChIKey | SFPQDYSOPQHZAQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Methoxypropanenitrile (CAS 26856-69-9), with molecular formula C4H7NO and molecular weight 85.05 g/mol. IUPAC: 2-methoxypropanenitrile.
Chemical Property Profile of 2-Methoxypropanenitrile
Property Insights of 2-Methoxypropanenitrile
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methoxypropanenitrile. With a topological polar surface area (TPSA) of 33.0 Ų, 2-Methoxypropanenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methoxypropanenitrile has 0 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 2-Methoxypropanenitrile?
The CAS number of 2-Methoxypropanenitrile is 26856-69-9.
What is the molecular formula of 2-Methoxypropanenitrile?
The molecular formula of 2-Methoxypropanenitrile is C4H7NO.
What is the molecular weight of 2-Methoxypropanenitrile?
The molecular weight of 2-Methoxypropanenitrile is 85.05 g/mol.
Where can I buy 2-Methoxypropanenitrile?
You can request a quote for 2-Methoxypropanenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methoxypropanenitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-Methoxypropanenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.