4-甲氧基苯基二甲磷酸酯
TL;DR: 4-甲氧基苯基二甲磷酸酯 (CAS 96323-20-5) is a chemical compound with molecular formula C9H13O5P and molecular weight 232.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-甲氧基苯基二甲磷酸酯
(4-methoxyphenyl) dimethyl phosphate
Also Known As: 4-Methoxyphenyl dimethyl phosphate, (4-methoxyphenyl) dimethyl phosphate, Dimethyl 4-methoxyphenyl phosphate, 4-Methoxyphenyl dimethyl phosphate #, Phosphoric acid, 4-methoxyphenyl dimethyl ester
| Molecular Formula | C9H13O5P |
|---|---|
| Molecular Weight | 232.05 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 54.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 232.05006 |
| Heavy Atoms | 15 |
| Complexity | 217.0 |
Chemical Identifiers
| CAS Number | 96323-20-5 |
|---|---|
| SMILES | COC1=CC=C(C=C1)OP(=O)(OC)OC |
| InChIKey | PHQVYYOBMMIRNS-UHFFFAOYSA-N |
Product Overview
4-甲氧基苯基二甲磷酸酯 (CAS 96323-20-5), with molecular formula C9H13O5P and molecular weight 232.05 g/mol. IUPAC: (4-methoxyphenyl) dimethyl phosphate.
Chemical Property Profile of 4-甲氧基苯基二甲磷酸酯
Property Insights of 4-甲氧基苯基二甲磷酸酯
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-甲氧基苯基二甲磷酸酯. With a topological polar surface area (TPSA) of 54.0 Ų, 4-甲氧基苯基二甲磷酸酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-甲氧基苯基二甲磷酸酯 has 0 hydrogen bond donor(s) and 5 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 4-甲氧基苯基二甲磷酸酯?
The CAS number of 4-甲氧基苯基二甲磷酸酯 is 96323-20-5.
What is the molecular formula of 4-甲氧基苯基二甲磷酸酯?
The molecular formula of 4-甲氧基苯基二甲磷酸酯 is C9H13O5P.
What is the molecular weight of 4-甲氧基苯基二甲磷酸酯?
The molecular weight of 4-甲氧基苯基二甲磷酸酯 is 232.05 g/mol.
Where can I buy 4-甲氧基苯基二甲磷酸酯?
You can request a quote for 4-甲氧基苯基二甲磷酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-甲氧基苯基二甲磷酸酯?
Yes, KEHONG BIO provides custom synthesis services for 4-甲氧基苯基二甲磷酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.