RefChem:173612
TL;DR: RefChem:173612 (CAS 751-83-7) is a chemical compound with molecular formula C33H38O4PS- and molecular weight 561.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2E,4E)-3-methyl-5-(2,6,6-trimethylcyclohexen-1-yl)penta-2,4-dienyl]-triphenylphosphanium sulfate
Also Known As: EINECS 212-028-2, EC 212-028-2, [(2E,4E)-3-methyl-5-(2,6,6-trimethylcyclohexen-1-yl)penta-2,4-dienyl]-triphenylphosphanium;sulfate, Phosphonium, (3-methyl-5-(2,6,6-trimethyl-1-cyclohexen-1-yl)-2,4-pentadien-1-yl)triphenyl-, sulfate (1:1), Phosphonium, (3-methyl-5-(2,6,6-trimethyl-1-cyclohexen-1-yl)-2,4-pentadienyl)triphenyl-, sulfate (1:1)
| Molecular Formula | C33H38O4PS- |
|---|---|
| Molecular Weight | 561.22 g/mol |
| LogP | 6.6716 |
| Topological Polar Surface Area | 80.26 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 561.22284 |
| Heavy Atoms | 39 |
| Complexity | 1303.6364 |
Chemical Identifiers
| CAS Number | 751-83-7 |
|---|---|
| SMILES | CC1=C(C(CCC1)(C)C)/C=C/C(=C/C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)/C.[O-]S(=O)(=O)[O-] |
Product Overview
RefChem:173612 (CAS 751-83-7), with molecular formula C33H38O4PS- and molecular weight 561.22 g/mol. IUPAC: [(2E,4E)-3-methyl-5-(2,6,6-trimethylcyclohexen-1-yl)penta-2,4-dienyl]-triphenylphosphanium sulfate.
Chemical Property Profile of RefChem:173612
Property Insights of RefChem:173612
The XLogP value of 6.6716 indicates that RefChem:173612 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.26 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:173612. Following Lipinski's Rule of Five, RefChem:173612 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 RefChem:173612?
The CAS number of RefChem:173612 is 751-83-7.
What is the molecular formula of RefChem:173612?
The molecular formula of RefChem:173612 is C33H38O4PS-.
What is the molecular weight of RefChem:173612?
The molecular weight of RefChem:173612 is 561.22 g/mol.
Where can I buy RefChem:173612?
You can request a quote for RefChem:173612 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:173612?
Yes, KEHONG BIO provides custom synthesis services for RefChem:173612 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.