2-(4-Chlorophenyl)-3-(2,4-dichlorophenyl)prop-2-enenitrile
TL;DR: 2-(4-Chlorophenyl)-3-(2,4-dichlorophenyl)prop-2-enenitrile (CAS 2958-45-4) is a chemical compound with molecular formula C15H8Cl3N and molecular weight 306.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chlorophenyl)-3-(2,4-dichlorophenyl)prop-2-enenitrile
Also Known As: 2-(4-Chloro-phenyl)-3-(2,4-dichloro-phenyl)-acrylonitrile, 2-(4-chlorophenyl)-3-(2,4-dichlorophenyl)prop-2-enenitrile
| Molecular Formula | C15H8Cl3N |
|---|---|
| Molecular Weight | 306.97 g/mol |
| LogP | 5.71098 |
| Topological Polar Surface Area | 23.79 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 306.97223 |
| Heavy Atoms | 19 |
| Complexity | 666.78033 |
Chemical Identifiers
| CAS Number | 2958-45-4 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=CC2=C(C=C(C=C2)Cl)Cl)C#N)Cl |
Product Overview
2-(4-Chlorophenyl)-3-(2,4-dichlorophenyl)prop-2-enenitrile (CAS 2958-45-4), with molecular formula C15H8Cl3N and molecular weight 306.97 g/mol. IUPAC: 2-(4-chlorophenyl)-3-(2,4-dichlorophenyl)prop-2-enenitrile.
Chemical Property Profile of 2-(4-Chlorophenyl)-3-(2,4-dichlorophenyl)prop-2-enenitrile
Property Insights of 2-(4-Chlorophenyl)-3-(2,4-dichlorophenyl)prop-2-enenitrile
The XLogP value of 5.71098 indicates that 2-(4-Chlorophenyl)-3-(2,4-dichlorophenyl)prop-2-enenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.79 Ų, 2-(4-Chlorophenyl)-3-(2,4-dichlorophenyl)prop-2-enenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Chlorophenyl)-3-(2,4-dichlorophenyl)prop-2-enenitrile has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(4-Chlorophenyl)-3-(2,4-dichlorophenyl)prop-2-enenitrile?
The CAS number of 2-(4-Chlorophenyl)-3-(2,4-dichlorophenyl)prop-2-enenitrile is 2958-45-4.
What is the molecular formula of 2-(4-Chlorophenyl)-3-(2,4-dichlorophenyl)prop-2-enenitrile?
The molecular formula of 2-(4-Chlorophenyl)-3-(2,4-dichlorophenyl)prop-2-enenitrile is C15H8Cl3N.
What is the molecular weight of 2-(4-Chlorophenyl)-3-(2,4-dichlorophenyl)prop-2-enenitrile?
The molecular weight of 2-(4-Chlorophenyl)-3-(2,4-dichlorophenyl)prop-2-enenitrile is 306.97 g/mol.
Where can I buy 2-(4-Chlorophenyl)-3-(2,4-dichlorophenyl)prop-2-enenitrile?
You can request a quote for 2-(4-Chlorophenyl)-3-(2,4-dichlorophenyl)prop-2-enenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Chlorophenyl)-3-(2,4-dichlorophenyl)prop-2-enenitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Chlorophenyl)-3-(2,4-dichlorophenyl)prop-2-enenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.