alpha-Phenyl-2-furanacrylonitrile
TL;DR: alpha-Phenyl-2-furanacrylonitrile (CAS 1207-91-6) is a chemical compound with molecular formula C13H9NO and molecular weight 195.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(furan-2-yl)-2-phenylprop-2-enenitrile
Also Known As: ALPHA-PHENYL-2-FURANACRYLONITRILE, 3-(furan-2-yl)-2-phenylprop-2-enenitrile, (E)-3-(furan-2-yl)-2-phenylprop-2-enenitrile
| Molecular Formula | C13H9NO |
|---|---|
| Molecular Weight | 195.07 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 36.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 195.06842 |
| Heavy Atoms | 15 |
| Complexity | 280.0 |
Chemical Identifiers
| CAS Number | 1207-91-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=CC2=CC=CO2)C#N |
| InChIKey | KIVIUFMRHGKARE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
alpha-Phenyl-2-furanacrylonitrile (CAS 1207-91-6), with molecular formula C13H9NO and molecular weight 195.07 g/mol. IUPAC: 3-(furan-2-yl)-2-phenylprop-2-enenitrile.
Chemical Property Profile of alpha-Phenyl-2-furanacrylonitrile
Property Insights of alpha-Phenyl-2-furanacrylonitrile
The XLogP value of 3.1 indicates that alpha-Phenyl-2-furanacrylonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.9 Ų, alpha-Phenyl-2-furanacrylonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, alpha-Phenyl-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 alpha-Phenyl-2-furanacrylonitrile?
The CAS number of alpha-Phenyl-2-furanacrylonitrile is 1207-91-6.
What is the molecular formula of alpha-Phenyl-2-furanacrylonitrile?
The molecular formula of alpha-Phenyl-2-furanacrylonitrile is C13H9NO.
What is the molecular weight of alpha-Phenyl-2-furanacrylonitrile?
The molecular weight of alpha-Phenyl-2-furanacrylonitrile is 195.07 g/mol.
Where can I buy alpha-Phenyl-2-furanacrylonitrile?
You can request a quote for alpha-Phenyl-2-furanacrylonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for alpha-Phenyl-2-furanacrylonitrile?
Yes, KEHONG BIO provides custom synthesis services for alpha-Phenyl-2-furanacrylonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.