3-Methoxy-2-propenenitrile
TL;DR: 3-Methoxy-2-propenenitrile (CAS 69194-04-3) is a chemical compound with molecular formula C4H5NO and molecular weight 83.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methoxyprop-2-enenitrile
Also Known As: 3-Methoxyacrylonitrile, 3-Methoxy-2-Propenenitrile, 3-methoxyprop-2-enenitrile, 3-methoxy-acrylonitrile, 2-Propenenitrile, 3-methoxy-
| Molecular Formula | C4H5NO |
|---|---|
| Molecular Weight | 83.04 g/mol |
| LogP | 0.67008 |
| Topological Polar Surface Area | 33.02 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 83.03712 |
| Heavy Atoms | 6 |
| Complexity | 80.0391 |
Chemical Identifiers
| CAS Number | 69194-04-3 |
|---|---|
| SMILES | COC=CC#N |
Product Overview
3-Methoxy-2-propenenitrile (CAS 69194-04-3), with molecular formula C4H5NO and molecular weight 83.04 g/mol. IUPAC: 3-methoxyprop-2-enenitrile.
Chemical Property Profile of 3-Methoxy-2-propenenitrile
Property Insights of 3-Methoxy-2-propenenitrile
The XLogP value of 0.67008 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methoxy-2-propenenitrile. With a topological polar surface area (TPSA) of 33.02 Ų, 3-Methoxy-2-propenenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methoxy-2-propenenitrile 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 3-Methoxy-2-propenenitrile?
The CAS number of 3-Methoxy-2-propenenitrile is 69194-04-3.
What is the molecular formula of 3-Methoxy-2-propenenitrile?
The molecular formula of 3-Methoxy-2-propenenitrile is C4H5NO.
What is the molecular weight of 3-Methoxy-2-propenenitrile?
The molecular weight of 3-Methoxy-2-propenenitrile is 83.04 g/mol.
Where can I buy 3-Methoxy-2-propenenitrile?
You can request a quote for 3-Methoxy-2-propenenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methoxy-2-propenenitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-Methoxy-2-propenenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.