Dichloro(dichloromethyl)benzene
TL;DR: Dichloro(dichloromethyl)benzene (CAS 56961-83-2) is a chemical compound with molecular formula C7H4Cl4 and molecular weight 227.91 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4-dichloro-2-(dichloromethyl)benzene
Also Known As: 1,4-dichloro-2-(dichloromethyl)benzene, DEPO, Dichloro(dichloromethyl)benzene, 2,5-Dichlor-benzalchlorid, 2,5-dichlorobenzal chloride
| Molecular Formula | C7H4Cl4 |
|---|---|
| Molecular Weight | 227.91 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 229.90376 |
| Heavy Atoms | 11 |
| Complexity | 126.0 |
Chemical Identifiers
| CAS Number | 56961-83-2 |
|---|---|
| SMILES | C1=CC(=C(C=C1Cl)C(Cl)Cl)Cl |
| InChIKey | VBPLROSJWVETJQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dichloro(dichloromethyl)benzene (CAS 56961-83-2), with molecular formula C7H4Cl4 and molecular weight 227.91 g/mol. IUPAC: 1,4-dichloro-2-(dichloromethyl)benzene.
Chemical Property Profile of Dichloro(dichloromethyl)benzene
Property Insights of Dichloro(dichloromethyl)benzene
The XLogP value of 4.3 indicates that Dichloro(dichloromethyl)benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Dichloro(dichloromethyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dichloro(dichloromethyl)benzene has 0 hydrogen bond donor(s) and 0 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 Dichloro(dichloromethyl)benzene?
The CAS number of Dichloro(dichloromethyl)benzene is 56961-83-2.
What is the molecular formula of Dichloro(dichloromethyl)benzene?
The molecular formula of Dichloro(dichloromethyl)benzene is C7H4Cl4.
What is the molecular weight of Dichloro(dichloromethyl)benzene?
The molecular weight of Dichloro(dichloromethyl)benzene is 227.91 g/mol.
Where can I buy Dichloro(dichloromethyl)benzene?
You can request a quote for Dichloro(dichloromethyl)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dichloro(dichloromethyl)benzene?
Yes, KEHONG BIO provides custom synthesis services for Dichloro(dichloromethyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.