Triphenyl(2-carboethoxyethyl)phosphonium bromide
TL;DR: Triphenyl(2-carboethoxyethyl)phosphonium bromide (CAS 42843-95-8) is a chemical compound with molecular formula C23H24BrO2P and molecular weight 442.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-ethoxy-3-oxopropyl)-triphenylphosphanium bromide
Also Known As: (3-Ethoxy-3-oxopropyl)triphenylphosphonium bromide, 2-(Ethoxycarbonyl)ethyltriphenylphosphonium bromide, Methyl-beta-D-xylopyranoside, Ethyl 3-(triphenylphosphoranyl)propanoate, 5915AB
| Molecular Formula | C23H24BrO2P |
|---|---|
| Molecular Weight | 442.07 g/mol |
| LogP | 0.9377 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 442.06973 |
| Heavy Atoms | 27 |
| Complexity | 726.1078 |
Chemical Identifiers
| CAS Number | 42843-95-8 |
|---|---|
| SMILES | CCOC(=O)CC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-] |
Product Overview
Triphenyl(2-carboethoxyethyl)phosphonium bromide (CAS 42843-95-8), with molecular formula C23H24BrO2P and molecular weight 442.07 g/mol. IUPAC: (3-ethoxy-3-oxopropyl)-triphenylphosphanium bromide.
Chemical Property Profile of Triphenyl(2-carboethoxyethyl)phosphonium bromide
Property Insights of Triphenyl(2-carboethoxyethyl)phosphonium bromide
The XLogP value of 0.9377 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Triphenyl(2-carboethoxyethyl)phosphonium bromide. With a topological polar surface area (TPSA) of 26.3 Ų, Triphenyl(2-carboethoxyethyl)phosphonium bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Triphenyl(2-carboethoxyethyl)phosphonium bromide has 0 hydrogen bond donor(s) and 2 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 Triphenyl(2-carboethoxyethyl)phosphonium bromide?
The CAS number of Triphenyl(2-carboethoxyethyl)phosphonium bromide is 42843-95-8.
What is the molecular formula of Triphenyl(2-carboethoxyethyl)phosphonium bromide?
The molecular formula of Triphenyl(2-carboethoxyethyl)phosphonium bromide is C23H24BrO2P.
What is the molecular weight of Triphenyl(2-carboethoxyethyl)phosphonium bromide?
The molecular weight of Triphenyl(2-carboethoxyethyl)phosphonium bromide is 442.07 g/mol.
Where can I buy Triphenyl(2-carboethoxyethyl)phosphonium bromide?
You can request a quote for Triphenyl(2-carboethoxyethyl)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(2-carboethoxyethyl)phosphonium bromide?
Yes, KEHONG BIO provides custom synthesis services for Triphenyl(2-carboethoxyethyl)phosphonium bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.