Phosphonic acid, (1-methylethyl)-, bis(2-t-butylphenyl) ester
TL;DR: Phosphonic acid, (1-methylethyl)-, bis(2-t-butylphenyl) ester (CAS 123872-76-4) is a chemical compound with molecular formula C23H33O3P and molecular weight 388.22 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)-propan-2-ylphosphoryl]oxybenzene
Also Known As: Phosphonic acid, (1-methylethyl)-, bis(2-t-butylphenyl) ester, Bis(4-tert-butylphenyl) propan-2-ylphosphonate, 1-[propan-2-yl-(4-tert-butylphenoxy)phosphoryl]oxy-4-tert-butyl-benzene, 1-tert-butyl-4-[(4-tert-butylphenoxy)-propan-2-ylphosphoryl]oxybenzene
| Molecular Formula | C23H33O3P |
|---|---|
| Molecular Weight | 388.22 g/mol |
| LogP | 7.2 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 388.21674 |
| Heavy Atoms | 27 |
| Complexity | 459.0 |
Chemical Identifiers
| CAS Number | 123872-76-4 |
|---|---|
| SMILES | CC(C)P(=O)(OC1=CC=C(C=C1)C(C)(C)C)OC2=CC=C(C=C2)C(C)(C)C |
| InChIKey | DTTYLOMLSWKOPW-UHFFFAOYSA-N |
Product Overview
Phosphonic acid, (1-methylethyl)-, bis(2-t-butylphenyl) ester (CAS 123872-76-4), with molecular formula C23H33O3P and molecular weight 388.22 g/mol. IUPAC: 1-tert-butyl-4-[(4-tert-butylphenoxy)-propan-2-ylphosphoryl]oxybenzene.
Chemical Property Profile of Phosphonic acid, (1-methylethyl)-, bis(2-t-butylphenyl) ester
Property Insights of Phosphonic acid, (1-methylethyl)-, bis(2-t-butylphenyl) ester
The XLogP value of 7.2 indicates that Phosphonic acid, (1-methylethyl)-, bis(2-t-butylphenyl) ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, Phosphonic acid, (1-methylethyl)-, bis(2-t-butylphenyl) ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phosphonic acid, (1-methylethyl)-, bis(2-t-butylphenyl) 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 Phosphonic acid, (1-methylethyl)-, bis(2-t-butylphenyl) ester?
The CAS number of Phosphonic acid, (1-methylethyl)-, bis(2-t-butylphenyl) ester is 123872-76-4.
What is the molecular formula of Phosphonic acid, (1-methylethyl)-, bis(2-t-butylphenyl) ester?
The molecular formula of Phosphonic acid, (1-methylethyl)-, bis(2-t-butylphenyl) ester is C23H33O3P.
What is the molecular weight of Phosphonic acid, (1-methylethyl)-, bis(2-t-butylphenyl) ester?
The molecular weight of Phosphonic acid, (1-methylethyl)-, bis(2-t-butylphenyl) ester is 388.22 g/mol.
Where can I buy Phosphonic acid, (1-methylethyl)-, bis(2-t-butylphenyl) ester?
You can request a quote for Phosphonic acid, (1-methylethyl)-, bis(2-t-butylphenyl) ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphonic acid, (1-methylethyl)-, bis(2-t-butylphenyl) ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphonic acid, (1-methylethyl)-, bis(2-t-butylphenyl) ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.