2-(2,4-Dichlorobenzyl)malononitrile
TL;DR: 2-(2,4-Dichlorobenzyl)malononitrile (CAS 338965-08-5) is a chemical compound with molecular formula C10H6Cl2N2 and molecular weight 223.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2,4-dichlorophenyl)methyl]propanedinitrile
Also Known As: 2-(2,4-dichlorobenzyl)malononitrile, 2-[(2,4-dichlorophenyl)methyl]propanedinitrile, dichlorobenzylmalononitrile, 2,4-Dichlorobenzylmalononitrile, (2,4-dichlorobenzyl)malononitrile
| Molecular Formula | C10H6Cl2N2 |
|---|---|
| Molecular Weight | 223.99 g/mol |
| LogP | 3.19926 |
| Topological Polar Surface Area | 47.58 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 223.9908 |
| Heavy Atoms | 14 |
| Complexity | 401.11066 |
Chemical Identifiers
| CAS Number | 338965-08-5 |
|---|---|
| SMILES | C1=CC(=C(C=C1Cl)Cl)CC(C#N)C#N |
Product Overview
2-(2,4-Dichlorobenzyl)malononitrile (CAS 338965-08-5), with molecular formula C10H6Cl2N2 and molecular weight 223.99 g/mol. IUPAC: 2-[(2,4-dichlorophenyl)methyl]propanedinitrile.
Chemical Property Profile of 2-(2,4-Dichlorobenzyl)malononitrile
Property Insights of 2-(2,4-Dichlorobenzyl)malononitrile
The XLogP value of 3.19926 indicates that 2-(2,4-Dichlorobenzyl)malononitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.58 Ų, 2-(2,4-Dichlorobenzyl)malononitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2,4-Dichlorobenzyl)malononitrile 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-Dichlorobenzyl)malononitrile?
The CAS number of 2-(2,4-Dichlorobenzyl)malononitrile is 338965-08-5.
What is the molecular formula of 2-(2,4-Dichlorobenzyl)malononitrile?
The molecular formula of 2-(2,4-Dichlorobenzyl)malononitrile is C10H6Cl2N2.
What is the molecular weight of 2-(2,4-Dichlorobenzyl)malononitrile?
The molecular weight of 2-(2,4-Dichlorobenzyl)malononitrile is 223.99 g/mol.
Where can I buy 2-(2,4-Dichlorobenzyl)malononitrile?
You can request a quote for 2-(2,4-Dichlorobenzyl)malononitrile 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-Dichlorobenzyl)malononitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(2,4-Dichlorobenzyl)malononitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.