Phosphoric acid, cyclic 1-methyltrimethylene m-tolyl ester
TL;DR: Phosphoric acid, cyclic 1-methyltrimethylene m-tolyl ester (CAS 73972-77-7) is a chemical compound with molecular formula C11H15O4P and molecular weight 242.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-2-(3-methylphenoxy)-1,3,2λ5-dioxaphosphinane 2-oxide
Also Known As: 1,3-Butylene m-tolyl phosphate, 4-methyl-2-(3-methylphenoxy)-1,3,2, Phosphoric acid, cyclic 1-methyltrimethylene m-tolyl ester, 1,3,2-Dioxaphosphorinane, 4-methyl-2-(m-tolyloxy)-, 2-oxide, 1-(m-Tolyloxy)-3-methyl-2,6-dioxaphosphorinane 1-oxide
| Molecular Formula | C11H15O4P |
|---|---|
| Molecular Weight | 242.07 g/mol |
| LogP | 3.30732 |
| Topological Polar Surface Area | 44.76 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 242.0708 |
| Heavy Atoms | 16 |
| Complexity | 418.20053 |
Chemical Identifiers
| CAS Number | 73972-77-7 |
|---|---|
| SMILES | CC1CCOP(=O)(O1)OC2=CC=CC(=C2)C |
Product Overview
Phosphoric acid, cyclic 1-methyltrimethylene m-tolyl ester (CAS 73972-77-7), with molecular formula C11H15O4P and molecular weight 242.07 g/mol. IUPAC: 4-methyl-2-(3-methylphenoxy)-1,3,2λ5-dioxaphosphinane 2-oxide.
Chemical Property Profile of Phosphoric acid, cyclic 1-methyltrimethylene m-tolyl ester
Property Insights of Phosphoric acid, cyclic 1-methyltrimethylene m-tolyl ester
The XLogP value of 3.30732 indicates that Phosphoric acid, cyclic 1-methyltrimethylene m-tolyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.76 Ų, Phosphoric acid, cyclic 1-methyltrimethylene m-tolyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phosphoric acid, cyclic 1-methyltrimethylene m-tolyl ester has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Phosphoric acid, cyclic 1-methyltrimethylene m-tolyl ester?
The CAS number of Phosphoric acid, cyclic 1-methyltrimethylene m-tolyl ester is 73972-77-7.
What is the molecular formula of Phosphoric acid, cyclic 1-methyltrimethylene m-tolyl ester?
The molecular formula of Phosphoric acid, cyclic 1-methyltrimethylene m-tolyl ester is C11H15O4P.
What is the molecular weight of Phosphoric acid, cyclic 1-methyltrimethylene m-tolyl ester?
The molecular weight of Phosphoric acid, cyclic 1-methyltrimethylene m-tolyl ester is 242.07 g/mol.
Where can I buy Phosphoric acid, cyclic 1-methyltrimethylene m-tolyl ester?
You can request a quote for Phosphoric acid, cyclic 1-methyltrimethylene m-tolyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphoric acid, cyclic 1-methyltrimethylene m-tolyl ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphoric acid, cyclic 1-methyltrimethylene m-tolyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.