2-Methoxy-1,2-diphenyl-4-(triphenylphosphoranyl)-1-butanone
TL;DR: 2-Methoxy-1,2-diphenyl-4-(triphenylphosphoranyl)-1-butanone (CAS 22950-50-1) is a chemical compound with molecular formula C35H32O2P+ and molecular weight 515.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-methoxy-4-oxo-3,4-diphenylbutyl)-triphenylphosphanium
Also Known As: 2-Methoxy-1,2-diphenyl-4-(triphenylphosphoranyl)-1-butanone, (3-methoxy-4-oxo-3,4-diphenylbutyl)-triphenylphosphanium, (3-methoxy-4-oxo-3,4-diphenyl-butyl)-triphenyl-phosphonium, Phosphonium,(3-benzoyl-3-methoxy-3-phenylpropyl)triphenyl-,iodide (8CI), Phosphonium,(3-methoxy-4-oxo-3,4-diphenylbutyl)triphenyl-, iodide (1:1)
| Molecular Formula | C35H32O2P+ |
|---|---|
| Molecular Weight | 515.21 g/mol |
| LogP | 7.8 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 10 |
| Exact Mass | 515.214 |
| Heavy Atoms | 38 |
| Complexity | 660.0 |
Chemical Identifiers
| CAS Number | 22950-50-1 |
|---|---|
| SMILES | COC(CC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)(C4=CC=CC=C4)C(=O)C5=CC=CC=C5 |
| InChIKey | UERYBYTVDBNLTR-UHFFFAOYSA-N |
Product Overview
2-Methoxy-1,2-diphenyl-4-(triphenylphosphoranyl)-1-butanone (CAS 22950-50-1), with molecular formula C35H32O2P+ and molecular weight 515.21 g/mol. IUPAC: (3-methoxy-4-oxo-3,4-diphenylbutyl)-triphenylphosphanium.
Chemical Property Profile of 2-Methoxy-1,2-diphenyl-4-(triphenylphosphoranyl)-1-butanone
Property Insights of 2-Methoxy-1,2-diphenyl-4-(triphenylphosphoranyl)-1-butanone
The XLogP value of 7.8 indicates that 2-Methoxy-1,2-diphenyl-4-(triphenylphosphoranyl)-1-butanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 2-Methoxy-1,2-diphenyl-4-(triphenylphosphoranyl)-1-butanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methoxy-1,2-diphenyl-4-(triphenylphosphoranyl)-1-butanone has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Methoxy-1,2-diphenyl-4-(triphenylphosphoranyl)-1-butanone?
The CAS number of 2-Methoxy-1,2-diphenyl-4-(triphenylphosphoranyl)-1-butanone is 22950-50-1.
What is the molecular formula of 2-Methoxy-1,2-diphenyl-4-(triphenylphosphoranyl)-1-butanone?
The molecular formula of 2-Methoxy-1,2-diphenyl-4-(triphenylphosphoranyl)-1-butanone is C35H32O2P+.
What is the molecular weight of 2-Methoxy-1,2-diphenyl-4-(triphenylphosphoranyl)-1-butanone?
The molecular weight of 2-Methoxy-1,2-diphenyl-4-(triphenylphosphoranyl)-1-butanone is 515.21 g/mol.
Where can I buy 2-Methoxy-1,2-diphenyl-4-(triphenylphosphoranyl)-1-butanone?
You can request a quote for 2-Methoxy-1,2-diphenyl-4-(triphenylphosphoranyl)-1-butanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methoxy-1,2-diphenyl-4-(triphenylphosphoranyl)-1-butanone?
Yes, KEHONG BIO provides custom synthesis services for 2-Methoxy-1,2-diphenyl-4-(triphenylphosphoranyl)-1-butanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.