Phosphorochloridic acid, bis[4-(1,1-dimethylethyl)phenyl] ester
TL;DR: Phosphorochloridic acid, bis[4-(1,1-dimethylethyl)phenyl] ester (CAS 72138-84-2) is a chemical compound with molecular formula C20H26ClO3P and molecular weight 380.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-tert-butyl-4-[(4-tert-butylphenoxy)-chlorophosphoryl]oxybenzene
Also Known As: Di-4-tert-butylphenyl phosphorochloridate, Di-p-tert-Butylphenyl Phosphorochloridate, Bis(tert-butylphenyl) chlorophosphate, Phosphorochloridic acid, bis[4-(1,1-dimethylethyl)phenyl] ester, bis(4-tert-butylphenyl) phosphorochloridate
| Molecular Formula | C20H26ClO3P |
|---|---|
| Molecular Weight | 380.13 g/mol |
| LogP | 7.0863 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 380.1308 |
| Heavy Atoms | 25 |
| Complexity | 690.0137 |
Chemical Identifiers
| CAS Number | 72138-84-2 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)OP(=O)(OC2=CC=C(C=C2)C(C)(C)C)Cl |
Product Overview
Phosphorochloridic acid, bis[4-(1,1-dimethylethyl)phenyl] ester (CAS 72138-84-2), with molecular formula C20H26ClO3P and molecular weight 380.13 g/mol. IUPAC: 1-tert-butyl-4-[(4-tert-butylphenoxy)-chlorophosphoryl]oxybenzene.
Chemical Property Profile of Phosphorochloridic acid, bis[4-(1,1-dimethylethyl)phenyl] ester
Property Insights of Phosphorochloridic acid, bis[4-(1,1-dimethylethyl)phenyl] ester
The XLogP value of 7.0863 indicates that Phosphorochloridic acid, bis[4-(1,1-dimethylethyl)phenyl] ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.53 Ų, Phosphorochloridic acid, bis[4-(1,1-dimethylethyl)phenyl] ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phosphorochloridic acid, bis[4-(1,1-dimethylethyl)phenyl] ester 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 Phosphorochloridic acid, bis[4-(1,1-dimethylethyl)phenyl] ester?
The CAS number of Phosphorochloridic acid, bis[4-(1,1-dimethylethyl)phenyl] ester is 72138-84-2.
What is the molecular formula of Phosphorochloridic acid, bis[4-(1,1-dimethylethyl)phenyl] ester?
The molecular formula of Phosphorochloridic acid, bis[4-(1,1-dimethylethyl)phenyl] ester is C20H26ClO3P.
What is the molecular weight of Phosphorochloridic acid, bis[4-(1,1-dimethylethyl)phenyl] ester?
The molecular weight of Phosphorochloridic acid, bis[4-(1,1-dimethylethyl)phenyl] ester is 380.13 g/mol.
Where can I buy Phosphorochloridic acid, bis[4-(1,1-dimethylethyl)phenyl] ester?
You can request a quote for Phosphorochloridic acid, bis[4-(1,1-dimethylethyl)phenyl] ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphorochloridic acid, bis[4-(1,1-dimethylethyl)phenyl] ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphorochloridic acid, bis[4-(1,1-dimethylethyl)phenyl] ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.