3,4-Dichlorobenzyltriphenylphosphonium chloride
TL;DR: 3,4-Dichlorobenzyltriphenylphosphonium chloride (CAS 3687-70-5) is a chemical compound with molecular formula C25H20Cl3P and molecular weight 456.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3,4-dichlorophenyl)methyl-triphenylphosphanium chloride
Also Known As: Eulan NK, Oilan NKF, Eulan NKU, Eulan NK, Eulan NKFW, 3,4-Dichlorobenzyltriphenylphosphonium chloride
| Molecular Formula | C25H20Cl3P |
|---|---|
| Molecular Weight | 456.04 g/mol |
| LogP | 3.49 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 456.03683 |
| Heavy Atoms | 29 |
| Complexity | 418.0 |
Chemical Identifiers
| CAS Number | 3687-70-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)[P+](CC2=CC(=C(C=C2)Cl)Cl)(C3=CC=CC=C3)C4=CC=CC=C4.[Cl-] |
| InChIKey | LZXHHNKULPHARO-UHFFFAOYSA-M |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,4-Dichlorobenzyltriphenylphosphonium chloride (CAS 3687-70-5), with molecular formula C25H20Cl3P and molecular weight 456.04 g/mol. IUPAC: (3,4-dichlorophenyl)methyl-triphenylphosphanium chloride.
Chemical Property Profile of 3,4-Dichlorobenzyltriphenylphosphonium chloride
Property Insights of 3,4-Dichlorobenzyltriphenylphosphonium chloride
The XLogP value of 3.49 indicates that 3,4-Dichlorobenzyltriphenylphosphonium chloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 3,4-Dichlorobenzyltriphenylphosphonium chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4-Dichlorobenzyltriphenylphosphonium chloride 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 3,4-Dichlorobenzyltriphenylphosphonium chloride?
The CAS number of 3,4-Dichlorobenzyltriphenylphosphonium chloride is 3687-70-5.
What is the molecular formula of 3,4-Dichlorobenzyltriphenylphosphonium chloride?
The molecular formula of 3,4-Dichlorobenzyltriphenylphosphonium chloride is C25H20Cl3P.
What is the molecular weight of 3,4-Dichlorobenzyltriphenylphosphonium chloride?
The molecular weight of 3,4-Dichlorobenzyltriphenylphosphonium chloride is 456.04 g/mol.
Where can I buy 3,4-Dichlorobenzyltriphenylphosphonium chloride?
You can request a quote for 3,4-Dichlorobenzyltriphenylphosphonium chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-Dichlorobenzyltriphenylphosphonium chloride?
Yes, KEHONG BIO provides custom synthesis services for 3,4-Dichlorobenzyltriphenylphosphonium chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.