Pcb 114
TL;DR: Pcb 114 (CAS 74472-37-0) is a chemical compound with molecular formula C12H5Cl5 and molecular weight 323.88 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,3,4-tetrachloro-5-(4-chlorophenyl)benzene
Also Known As: 2,3,4,4',5-PENTACHLOROBIPHENYL, PCB 114, VINYLIDENEBROMIDE, Bifonazole Impurity 49, PCB No. 114
| Molecular Formula | C12H5Cl5 |
|---|---|
| Molecular Weight | 323.88 g/mol |
| LogP | 7.0 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 325.88043 |
| Heavy Atoms | 17 |
| Complexity | 251.0 |
Chemical Identifiers
| CAS Number | 74472-37-0 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=CC(=C(C(=C2Cl)Cl)Cl)Cl)Cl |
| InChIKey | SXZSFWHOSHAKMN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Pcb 114 (CAS 74472-37-0), with molecular formula C12H5Cl5 and molecular weight 323.88 g/mol. IUPAC: 1,2,3,4-tetrachloro-5-(4-chlorophenyl)benzene.
Chemical Property Profile of Pcb 114
Property Insights of Pcb 114
The XLogP value of 7.0 indicates that Pcb 114 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Pcb 114 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pcb 114 has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Pcb 114?
The CAS number of Pcb 114 is 74472-37-0.
What is the molecular formula of Pcb 114?
The molecular formula of Pcb 114 is C12H5Cl5.
What is the molecular weight of Pcb 114?
The molecular weight of Pcb 114 is 323.88 g/mol.
Where can I buy Pcb 114?
You can request a quote for Pcb 114 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pcb 114?
Yes, KEHONG BIO provides custom synthesis services for Pcb 114 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.