Tris(4-ethyl-o-tolyl) phosphate
TL;DR: Tris(4-ethyl-o-tolyl) phosphate (CAS 84642-71-7) is a chemical compound with molecular formula C27H33O4P and molecular weight 452.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tris(4-ethyl-2-methylphenyl) phosphate
Also Known As: Tris phosphate, Tris(4-ethyl-o-tolyl) phosphate, EINECS 283-449-7, tris(4-ethyl-2-methylphenyl) phosphate, 4-ETHYL-O-CRESOL PHOSPHATE
| Molecular Formula | C27H33O4P |
|---|---|
| Molecular Weight | 452.21 g/mol |
| LogP | 7.94396 |
| Topological Polar Surface Area | 44.76 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 452.21164 |
| Heavy Atoms | 32 |
| Complexity | 995.03754 |
Chemical Identifiers
| CAS Number | 84642-71-7 |
|---|---|
| SMILES | CCC1=CC(=C(C=C1)OP(=O)(OC2=C(C=C(C=C2)CC)C)OC3=C(C=C(C=C3)CC)C)C |
Product Overview
Tris(4-ethyl-o-tolyl) phosphate (CAS 84642-71-7), with molecular formula C27H33O4P and molecular weight 452.21 g/mol. IUPAC: tris(4-ethyl-2-methylphenyl) phosphate.
Chemical Property Profile of Tris(4-ethyl-o-tolyl) phosphate
Property Insights of Tris(4-ethyl-o-tolyl) phosphate
The XLogP value of 7.94396 indicates that Tris(4-ethyl-o-tolyl) phosphate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.76 Ų, Tris(4-ethyl-o-tolyl) phosphate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tris(4-ethyl-o-tolyl) phosphate 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 Tris(4-ethyl-o-tolyl) phosphate?
The CAS number of Tris(4-ethyl-o-tolyl) phosphate is 84642-71-7.
What is the molecular formula of Tris(4-ethyl-o-tolyl) phosphate?
The molecular formula of Tris(4-ethyl-o-tolyl) phosphate is C27H33O4P.
What is the molecular weight of Tris(4-ethyl-o-tolyl) phosphate?
The molecular weight of Tris(4-ethyl-o-tolyl) phosphate is 452.21 g/mol.
Where can I buy Tris(4-ethyl-o-tolyl) phosphate?
You can request a quote for Tris(4-ethyl-o-tolyl) phosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tris(4-ethyl-o-tolyl) phosphate?
Yes, KEHONG BIO provides custom synthesis services for Tris(4-ethyl-o-tolyl) phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.