Phenol, 4-(1,1-dimethylpropyl)-, 1,1',1''-phosphite
TL;DR: Phenol, 4-(1,1-dimethylpropyl)-, 1,1',1''-phosphite (CAS 864-56-2) is a chemical compound with molecular formula C33H45O3P and molecular weight 520.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tris[4-(2-methylbutan-2-yl)phenyl] phosphite
Also Known As: tris phosphite, Tris(p-tert-amylphenyl) phosphite, Tris(p-tert-amylphenyl)phosphite, Phenol, p-tert-pentyl-, phosphite, Tris(p-tert-pentylphenyl) phosphite
| Molecular Formula | C33H45O3P |
|---|---|
| Molecular Weight | 520.31 g/mol |
| LogP | 12.2 |
| Topological Polar Surface Area | 27.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 12 |
| Exact Mass | 520.3106 |
| Heavy Atoms | 37 |
| Complexity | 560.0 |
Chemical Identifiers
| CAS Number | 864-56-2 |
|---|---|
| SMILES | CCC(C)(C)C1=CC=C(C=C1)OP(OC2=CC=C(C=C2)C(C)(C)CC)OC3=CC=C(C=C3)C(C)(C)CC |
| InChIKey | XGYJGDTVZLADOZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Phenol, 4-(1,1-dimethylpropyl)-, 1,1',1''-phosphite (CAS 864-56-2), with molecular formula C33H45O3P and molecular weight 520.31 g/mol. IUPAC: tris[4-(2-methylbutan-2-yl)phenyl] phosphite.
Chemical Property Profile of Phenol, 4-(1,1-dimethylpropyl)-, 1,1',1''-phosphite
Property Insights of Phenol, 4-(1,1-dimethylpropyl)-, 1,1',1''-phosphite
The XLogP value of 12.2 indicates that Phenol, 4-(1,1-dimethylpropyl)-, 1,1',1''-phosphite is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.7 Ų, Phenol, 4-(1,1-dimethylpropyl)-, 1,1',1''-phosphite exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenol, 4-(1,1-dimethylpropyl)-, 1,1',1''-phosphite has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Phenol, 4-(1,1-dimethylpropyl)-, 1,1',1''-phosphite?
The CAS number of Phenol, 4-(1,1-dimethylpropyl)-, 1,1',1''-phosphite is 864-56-2.
What is the molecular formula of Phenol, 4-(1,1-dimethylpropyl)-, 1,1',1''-phosphite?
The molecular formula of Phenol, 4-(1,1-dimethylpropyl)-, 1,1',1''-phosphite is C33H45O3P.
What is the molecular weight of Phenol, 4-(1,1-dimethylpropyl)-, 1,1',1''-phosphite?
The molecular weight of Phenol, 4-(1,1-dimethylpropyl)-, 1,1',1''-phosphite is 520.31 g/mol.
Where can I buy Phenol, 4-(1,1-dimethylpropyl)-, 1,1',1''-phosphite?
You can request a quote for Phenol, 4-(1,1-dimethylpropyl)-, 1,1',1''-phosphite directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenol, 4-(1,1-dimethylpropyl)-, 1,1',1''-phosphite?
Yes, KEHONG BIO provides custom synthesis services for Phenol, 4-(1,1-dimethylpropyl)-, 1,1',1''-phosphite and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.