4-Chlorobiphenyl
TL;DR: 4-Chlorobiphenyl (CAS 2051-62-9) is a chemical compound with molecular formula C12H9Cl and molecular weight 188.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chloro-4-phenylbenzene
Also Known As: 4-CHLOROBIPHENYL, 4-Chloro-1,1'-biphenyl, p-Chlorobiphenyl, p-Chlorodiphenyl, 4-Chlorodiphenyl
| Molecular Formula | C12H9Cl |
|---|---|
| Molecular Weight | 188.04 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 188.03928 |
| Heavy Atoms | 13 |
| Complexity | 141.0 |
| Melting Point | 77.7 °C |
| Boiling Point | 291.1 °C at 760 mmHg |
| Solubility | less than 1 mg/mL at 72 °F (NTP, 1992) |
| Vapor Pressure | 1 mmHg at 96.4 °C ; 10 mmHg at 146.0 °C; 760 mmHg at 292.9 °C |
Chemical Identifiers
| CAS Number | 2051-62-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=CC=C(C=C2)Cl |
| InChIKey | FPWNLURCHDRMHC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Chlorobiphenyl (CAS 2051-62-9), with molecular formula C12H9Cl and molecular weight 188.04 g/mol. IUPAC: 1-chloro-4-phenylbenzene.
Chemical Property Profile of 4-Chlorobiphenyl
Property Insights of 4-Chlorobiphenyl
The XLogP value of 4.6 indicates that 4-Chlorobiphenyl 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-Chlorobiphenyl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Chlorobiphenyl 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-Chlorobiphenyl?
The CAS number of 4-Chlorobiphenyl is 2051-62-9.
What is the molecular formula of 4-Chlorobiphenyl?
The molecular formula of 4-Chlorobiphenyl is C12H9Cl.
What is the molecular weight of 4-Chlorobiphenyl?
The molecular weight of 4-Chlorobiphenyl is 188.04 g/mol.
Where can I buy 4-Chlorobiphenyl?
You can request a quote for 4-Chlorobiphenyl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chlorobiphenyl?
Yes, KEHONG BIO provides custom synthesis services for 4-Chlorobiphenyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.