Benzene, chloro(dichlorofluoromethyl)-
TL;DR: Benzene, chloro(dichlorofluoromethyl)- (CAS 76057-14-2) is a chemical compound with molecular formula C7H4Cl3F and molecular weight 211.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chloro-2-[dichloro(fluoro)methyl]benzene
Also Known As: Chlorophenyldichlorofluoromethane, Benzene, chloro(dichlorofluoromethyl)-, Chloro(dichlorofluoromethyl)benzene, 1-chloro-2-[dichloro(fluoro)methyl]benzene, 1-Chloro-2-(dichlorofluoromethyl)benzene
| Molecular Formula | C7H4Cl3F |
|---|---|
| Molecular Weight | 211.94 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 211.93626 |
| Heavy Atoms | 11 |
| Complexity | 138.0 |
Chemical Identifiers
| CAS Number | 76057-14-2 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(F)(Cl)Cl)Cl |
| InChIKey | BPLLTHRIMHROHA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzene, chloro(dichlorofluoromethyl)- (CAS 76057-14-2), with molecular formula C7H4Cl3F and molecular weight 211.94 g/mol. IUPAC: 1-chloro-2-[dichloro(fluoro)methyl]benzene.
Chemical Property Profile of Benzene, chloro(dichlorofluoromethyl)-
Property Insights of Benzene, chloro(dichlorofluoromethyl)-
The XLogP value of 4.0 indicates that Benzene, chloro(dichlorofluoromethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Benzene, chloro(dichlorofluoromethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzene, chloro(dichlorofluoromethyl)- has 0 hydrogen bond donor(s) and 1 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 Benzene, chloro(dichlorofluoromethyl)-?
The CAS number of Benzene, chloro(dichlorofluoromethyl)- is 76057-14-2.
What is the molecular formula of Benzene, chloro(dichlorofluoromethyl)-?
The molecular formula of Benzene, chloro(dichlorofluoromethyl)- is C7H4Cl3F.
What is the molecular weight of Benzene, chloro(dichlorofluoromethyl)-?
The molecular weight of Benzene, chloro(dichlorofluoromethyl)- is 211.94 g/mol.
Where can I buy Benzene, chloro(dichlorofluoromethyl)-?
You can request a quote for Benzene, chloro(dichlorofluoromethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzene, chloro(dichlorofluoromethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzene, chloro(dichlorofluoromethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.