2-Furanacrylonitrile
TL;DR: 2-Furanacrylonitrile (CAS 7576-03-6) is a chemical compound with molecular formula C7H5NO and molecular weight 119.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(furan-2-yl)prop-2-enenitrile
Also Known As: 2-Furanacrylonitrile, 3-(Furan-2-yl)acrylonitrile, -3- acrylonitrile, (E)-3-(2-FURYL)ACRYLONITRILE, 3-(2-Furyl)acrylonitrile
| Molecular Formula | C7H5NO |
|---|---|
| Molecular Weight | 119.04 g/mol |
| LogP | 1.81638 |
| Topological Polar Surface Area | 36.93 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 119.03712 |
| Heavy Atoms | 9 |
| Complexity | 227.91887 |
Chemical Identifiers
| CAS Number | 7576-03-6 |
|---|---|
| SMILES | C1=COC(=C1)/C=C/C#N |
Product Overview
2-Furanacrylonitrile (CAS 7576-03-6), with molecular formula C7H5NO and molecular weight 119.04 g/mol. IUPAC: (E)-3-(furan-2-yl)prop-2-enenitrile.
Chemical Property Profile of 2-Furanacrylonitrile
Property Insights of 2-Furanacrylonitrile
The XLogP value of 1.81638 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Furanacrylonitrile. With a topological polar surface area (TPSA) of 36.93 Ų, 2-Furanacrylonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Furanacrylonitrile 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-Furanacrylonitrile?
The CAS number of 2-Furanacrylonitrile is 7576-03-6.
What is the molecular formula of 2-Furanacrylonitrile?
The molecular formula of 2-Furanacrylonitrile is C7H5NO.
What is the molecular weight of 2-Furanacrylonitrile?
The molecular weight of 2-Furanacrylonitrile is 119.04 g/mol.
Where can I buy 2-Furanacrylonitrile?
You can request a quote for 2-Furanacrylonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Furanacrylonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-Furanacrylonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.