(Z)-2-(4-Fluorophenyl)-3-phenylacrylonitrile
TL;DR: (Z)-2-(4-Fluorophenyl)-3-phenylacrylonitrile (CAS 54648-47-4) 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.
2-(4-fluorophenyl)-3-phenylprop-2-enenitrile
Also Known As: (Z)-2-(4-Fluorophenyl)-3-phenylacrylonitrile, 2-(4-fluorophenyl)-3-phenylprop-2-enenitrile, E-ALPHA-(4-FLUOROPHENYL)CINNAMONITRILE&, (2Z)-2-(4-Fluorophenyl)-3-phenylacrylonitrile, Benzeneacetonitrile,4-fluoro-a-(phenylmethylene)-
| 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 | 54648-47-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C=C(C#N)C2=CC=C(C=C2)F |
| InChIKey | AWMKCXLADSGTQN-UHFFFAOYSA-N |
Product Overview
(Z)-2-(4-Fluorophenyl)-3-phenylacrylonitrile (CAS 54648-47-4), with molecular formula C15H10FN and molecular weight 223.08 g/mol. IUPAC: 2-(4-fluorophenyl)-3-phenylprop-2-enenitrile.
Chemical Property Profile of (Z)-2-(4-Fluorophenyl)-3-phenylacrylonitrile
Property Insights of (Z)-2-(4-Fluorophenyl)-3-phenylacrylonitrile
The XLogP value of 3.8 indicates that (Z)-2-(4-Fluorophenyl)-3-phenylacrylonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.8 Ų, (Z)-2-(4-Fluorophenyl)-3-phenylacrylonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (Z)-2-(4-Fluorophenyl)-3-phenylacrylonitrile 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 (Z)-2-(4-Fluorophenyl)-3-phenylacrylonitrile?
The CAS number of (Z)-2-(4-Fluorophenyl)-3-phenylacrylonitrile is 54648-47-4.
What is the molecular formula of (Z)-2-(4-Fluorophenyl)-3-phenylacrylonitrile?
The molecular formula of (Z)-2-(4-Fluorophenyl)-3-phenylacrylonitrile is C15H10FN.
What is the molecular weight of (Z)-2-(4-Fluorophenyl)-3-phenylacrylonitrile?
The molecular weight of (Z)-2-(4-Fluorophenyl)-3-phenylacrylonitrile is 223.08 g/mol.
Where can I buy (Z)-2-(4-Fluorophenyl)-3-phenylacrylonitrile?
You can request a quote for (Z)-2-(4-Fluorophenyl)-3-phenylacrylonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-2-(4-Fluorophenyl)-3-phenylacrylonitrile?
Yes, KEHONG BIO provides custom synthesis services for (Z)-2-(4-Fluorophenyl)-3-phenylacrylonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.