Diethyl 4-methylphenyl phosphate
TL;DR: Diethyl 4-methylphenyl phosphate (CAS 4877-08-1) is a chemical compound with molecular formula C11H17O4P and molecular weight 244.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl (4-methylphenyl) phosphate
Also Known As: Diethyl 4-methylphenyl phosphate, Diethyl p-tolyl phosphate, Ethyl p-tolyl phosphate, diethyl (4-methylphenyl) phosphate, Phosphoric acid, diethyl 4-methylphenyl ester
| Molecular Formula | C11H17O4P |
|---|---|
| Molecular Weight | 244.09 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 244.08644 |
| Heavy Atoms | 16 |
| Complexity | 226.0 |
Chemical Identifiers
| CAS Number | 4877-08-1 |
|---|---|
| SMILES | CCOP(=O)(OCC)OC1=CC=C(C=C1)C |
| InChIKey | UBSNERLLCAIDQQ-UHFFFAOYSA-N |
Product Overview
Diethyl 4-methylphenyl phosphate (CAS 4877-08-1), with molecular formula C11H17O4P and molecular weight 244.09 g/mol. IUPAC: diethyl (4-methylphenyl) phosphate.
Chemical Property Profile of Diethyl 4-methylphenyl phosphate
Property Insights of Diethyl 4-methylphenyl phosphate
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethyl 4-methylphenyl phosphate. With a topological polar surface area (TPSA) of 44.8 Ų, Diethyl 4-methylphenyl phosphate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diethyl 4-methylphenyl phosphate 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 Diethyl 4-methylphenyl phosphate?
The CAS number of Diethyl 4-methylphenyl phosphate is 4877-08-1.
What is the molecular formula of Diethyl 4-methylphenyl phosphate?
The molecular formula of Diethyl 4-methylphenyl phosphate is C11H17O4P.
What is the molecular weight of Diethyl 4-methylphenyl phosphate?
The molecular weight of Diethyl 4-methylphenyl phosphate is 244.09 g/mol.
Where can I buy Diethyl 4-methylphenyl phosphate?
You can request a quote for Diethyl 4-methylphenyl phosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl 4-methylphenyl phosphate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl 4-methylphenyl phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.