Triphenyl(3,4,5-trimethoxybenzyl)phosphonium bromide
TL;DR: Triphenyl(3,4,5-trimethoxybenzyl)phosphonium bromide (CAS 61696-54-6) is a chemical compound with molecular formula C28H28BrO3P and molecular weight 522.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
triphenyl-[(3,4,5-trimethoxyphenyl)methyl]phosphanium bromide
Also Known As: triphenyl(3,4,5-trimethoxybenzyl)phosphonium bromide, TRIPHENYL- -PHOSPHONIUM,BROMIDE, TRIPHENYL-(3,4,5-TRIMETHOXY-BENZYL)-PHOSPHONIUM, BROMIDE, 3,4,5-trimethoxybenzyltriphenylphosphine bromide, 3,4,5-trimethoxybenzyltriphenylphosphonium bromide
| Molecular Formula | C28H28BrO3P |
|---|---|
| Molecular Weight | 522.10 g/mol |
| LogP | 2.2105 |
| Topological Polar Surface Area | 27.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 522.09595 |
| Heavy Atoms | 33 |
| Complexity | 477.0 |
Chemical Identifiers
| CAS Number | 61696-54-6 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-] |
| InChIKey | DFQCYFWOOKHMQB-UHFFFAOYSA-M |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Triphenyl(3,4,5-trimethoxybenzyl)phosphonium bromide (CAS 61696-54-6), with molecular formula C28H28BrO3P and molecular weight 522.10 g/mol. IUPAC: triphenyl-[(3,4,5-trimethoxyphenyl)methyl]phosphanium bromide.
Chemical Property Profile of Triphenyl(3,4,5-trimethoxybenzyl)phosphonium bromide
Property Insights of Triphenyl(3,4,5-trimethoxybenzyl)phosphonium bromide
The XLogP value of 2.2105 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Triphenyl(3,4,5-trimethoxybenzyl)phosphonium bromide. With a topological polar surface area (TPSA) of 27.7 Ų, Triphenyl(3,4,5-trimethoxybenzyl)phosphonium bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Triphenyl(3,4,5-trimethoxybenzyl)phosphonium bromide has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Triphenyl(3,4,5-trimethoxybenzyl)phosphonium bromide?
The CAS number of Triphenyl(3,4,5-trimethoxybenzyl)phosphonium bromide is 61696-54-6.
What is the molecular formula of Triphenyl(3,4,5-trimethoxybenzyl)phosphonium bromide?
The molecular formula of Triphenyl(3,4,5-trimethoxybenzyl)phosphonium bromide is C28H28BrO3P.
What is the molecular weight of Triphenyl(3,4,5-trimethoxybenzyl)phosphonium bromide?
The molecular weight of Triphenyl(3,4,5-trimethoxybenzyl)phosphonium bromide is 522.10 g/mol.
Where can I buy Triphenyl(3,4,5-trimethoxybenzyl)phosphonium bromide?
You can request a quote for Triphenyl(3,4,5-trimethoxybenzyl)phosphonium bromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Triphenyl(3,4,5-trimethoxybenzyl)phosphonium bromide?
Yes, KEHONG BIO provides custom synthesis services for Triphenyl(3,4,5-trimethoxybenzyl)phosphonium bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.