2-(2,4-Dichlorophenyl)-3-(dimethylamino)-acrylonitrile
TL;DR: 2-(2,4-Dichlorophenyl)-3-(dimethylamino)-acrylonitrile (CAS 339009-45-9) is a chemical compound with molecular formula C11H10Cl2N2 and molecular weight 240.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-2-(2,4-dichlorophenyl)-3-(dimethylamino)prop-2-enenitrile
Also Known As: 0804AE, dichlorophenyldimethylaminoacrylonitrile, 2-(2,4-DICHLOROPHENYL)-3-(DIMETHYLAMINO)-ACRYLONITRILE, 2-(2,4-dichlorophenyl)-3-(dimethylamino)acrylonitrile, 7F-017
| Molecular Formula | C11H10Cl2N2 |
|---|---|
| Molecular Weight | 240.02 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 27.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 240.02211 |
| Heavy Atoms | 15 |
| Complexity | 290.0 |
Chemical Identifiers
| CAS Number | 339009-45-9 |
|---|---|
| SMILES | CN(C)/C=C(\C#N)/C1=C(C=C(C=C1)Cl)Cl |
| InChIKey | QTBMTYBKXIUHHH-BQYQJAHWSA-N |
Product Overview
2-(2,4-Dichlorophenyl)-3-(dimethylamino)-acrylonitrile (CAS 339009-45-9), with molecular formula C11H10Cl2N2 and molecular weight 240.02 g/mol. IUPAC: (Z)-2-(2,4-dichlorophenyl)-3-(dimethylamino)prop-2-enenitrile.
Chemical Property Profile of 2-(2,4-Dichlorophenyl)-3-(dimethylamino)-acrylonitrile
Property Insights of 2-(2,4-Dichlorophenyl)-3-(dimethylamino)-acrylonitrile
The XLogP value of 3.2 indicates that 2-(2,4-Dichlorophenyl)-3-(dimethylamino)-acrylonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.0 Ų, 2-(2,4-Dichlorophenyl)-3-(dimethylamino)-acrylonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2,4-Dichlorophenyl)-3-(dimethylamino)-acrylonitrile 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-(2,4-Dichlorophenyl)-3-(dimethylamino)-acrylonitrile?
The CAS number of 2-(2,4-Dichlorophenyl)-3-(dimethylamino)-acrylonitrile is 339009-45-9.
What is the molecular formula of 2-(2,4-Dichlorophenyl)-3-(dimethylamino)-acrylonitrile?
The molecular formula of 2-(2,4-Dichlorophenyl)-3-(dimethylamino)-acrylonitrile is C11H10Cl2N2.
What is the molecular weight of 2-(2,4-Dichlorophenyl)-3-(dimethylamino)-acrylonitrile?
The molecular weight of 2-(2,4-Dichlorophenyl)-3-(dimethylamino)-acrylonitrile is 240.02 g/mol.
Where can I buy 2-(2,4-Dichlorophenyl)-3-(dimethylamino)-acrylonitrile?
You can request a quote for 2-(2,4-Dichlorophenyl)-3-(dimethylamino)-acrylonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2,4-Dichlorophenyl)-3-(dimethylamino)-acrylonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(2,4-Dichlorophenyl)-3-(dimethylamino)-acrylonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.