![alpha-[(4-Fluorophenyl)methylene]benzeneacetonitrile structure](/static/products/3246/324-61-8.webp)
alpha-[(4-Fluorophenyl)methylene]benzeneacetonitrile
TL;DR: alpha-[(4-Fluorophenyl)methylene]benzeneacetonitrile (CAS 324-61-8) is a chemical compound with molecular formula C15H10FN and molecular weight 223.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-fluorophenyl)-2-phenylprop-2-enenitrile
Also Known As: 3-(4-fluorophenyl)-2-phenylacrylonitrile, Benzene, 1-fluoro-4-(2-cyano-2-phenylethenyl), alpha-((4-Fluorophenyl)methylene)benzeneacetonitrile, alpha-[(4-Fluorophenyl)methylene]benzeneacetonitrile, I+/--[(4-Fluorophenyl)methylene]benzeneacetonitrile
| Molecular Formula | C15H10FN |
|---|---|
| Molecular Weight | 223.08 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 23.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 223.07973 |
| Heavy Atoms | 17 |
| Complexity | 311.0 |
Chemical Identifiers
| CAS Number | 324-61-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=CC2=CC=C(C=C2)F)C#N |
| InChIKey | GHNBNERCVAMXQK-UHFFFAOYSA-N |
Product Overview
alpha-[(4-Fluorophenyl)methylene]benzeneacetonitrile (CAS 324-61-8), with molecular formula C15H10FN and molecular weight 223.08 g/mol. IUPAC: 3-(4-fluorophenyl)-2-phenylprop-2-enenitrile.
Chemical Property Profile of alpha-[(4-Fluorophenyl)methylene]benzeneacetonitrile
Property Insights of alpha-[(4-Fluorophenyl)methylene]benzeneacetonitrile
The XLogP value of 3.8 indicates that alpha-[(4-Fluorophenyl)methylene]benzeneacetonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.8 Ų, alpha-[(4-Fluorophenyl)methylene]benzeneacetonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, alpha-[(4-Fluorophenyl)methylene]benzeneacetonitrile 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-[(4-Fluorophenyl)methylene]benzeneacetonitrile?
The CAS number of alpha-[(4-Fluorophenyl)methylene]benzeneacetonitrile is 324-61-8.
What is the molecular formula of alpha-[(4-Fluorophenyl)methylene]benzeneacetonitrile?
The molecular formula of alpha-[(4-Fluorophenyl)methylene]benzeneacetonitrile is C15H10FN.
What is the molecular weight of alpha-[(4-Fluorophenyl)methylene]benzeneacetonitrile?
The molecular weight of alpha-[(4-Fluorophenyl)methylene]benzeneacetonitrile is 223.08 g/mol.
Where can I buy alpha-[(4-Fluorophenyl)methylene]benzeneacetonitrile?
You can request a quote for alpha-[(4-Fluorophenyl)methylene]benzeneacetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for alpha-[(4-Fluorophenyl)methylene]benzeneacetonitrile?
Yes, KEHONG BIO provides custom synthesis services for alpha-[(4-Fluorophenyl)methylene]benzeneacetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.