(4-Chlorophenyl)phenylmethane
TL;DR: (4-Chlorophenyl)phenylmethane (CAS 831-81-2) is a chemical compound with molecular formula C13H11Cl and molecular weight 202.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-4-chlorobenzene
Also Known As: 4-Chlorodiphenylmethane, 1-Benzyl-4-chlorobenzene, p-Chlorobenzylbenzene, p-Chlorodiphenylmethane, 4-Chloroditan
| Molecular Formula | C13H11Cl |
|---|---|
| Molecular Weight | 202.05 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 202.05493 |
| Heavy Atoms | 14 |
| Complexity | 153.0 |
| Melting Point | 7.5 °C |
| Boiling Point | 298 °C @ 742 MM HG |
| Density | 1.1247 @ 20 °C/20 °C |
| Solubility | INSOL IN WATER, SOL IN ACETONE |
Chemical Identifiers
| CAS Number | 831-81-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC2=CC=C(C=C2)Cl |
| InChIKey | NPOGRKGIBGKRNI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(4-Chlorophenyl)phenylmethane (CAS 831-81-2), with molecular formula C13H11Cl and molecular weight 202.05 g/mol. IUPAC: 1-benzyl-4-chlorobenzene.
Chemical Property Profile of (4-Chlorophenyl)phenylmethane
Property Insights of (4-Chlorophenyl)phenylmethane
The XLogP value of 4.9 indicates that (4-Chlorophenyl)phenylmethane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, (4-Chlorophenyl)phenylmethane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-Chlorophenyl)phenylmethane 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 (4-Chlorophenyl)phenylmethane?
The CAS number of (4-Chlorophenyl)phenylmethane is 831-81-2.
What is the molecular formula of (4-Chlorophenyl)phenylmethane?
The molecular formula of (4-Chlorophenyl)phenylmethane is C13H11Cl.
What is the molecular weight of (4-Chlorophenyl)phenylmethane?
The molecular weight of (4-Chlorophenyl)phenylmethane is 202.05 g/mol.
Where can I buy (4-Chlorophenyl)phenylmethane?
You can request a quote for (4-Chlorophenyl)phenylmethane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Chlorophenyl)phenylmethane?
Yes, KEHONG BIO provides custom synthesis services for (4-Chlorophenyl)phenylmethane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.