甲基苯基磷酸氢酯
TL;DR: 甲基苯基磷酸氢酯 (CAS 4009-39-6) is a chemical compound with molecular formula C7H9O4P and molecular weight 188.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
甲基苯基磷酸氢酯
methyl phenyl hydrogen phosphate
Also Known As: methyl phenyl hydrogen phosphate, Methyl phenyl phosphate, Sofosbuvir Impurity 31, Sofosbuvir Impurity 79, Sofosbuvir Impurity 108
| Molecular Formula | C7H9O4P |
|---|---|
| Molecular Weight | 188.02 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 55.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 188.02385 |
| Heavy Atoms | 12 |
| Complexity | 176.0 |
Chemical Identifiers
| CAS Number | 4009-39-6 |
|---|---|
| SMILES | COP(=O)(O)OC1=CC=CC=C1 |
| InChIKey | BXVTXRIOHHFSQZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
甲基苯基磷酸氢酯 (CAS 4009-39-6), with molecular formula C7H9O4P and molecular weight 188.02 g/mol. IUPAC: methyl phenyl hydrogen phosphate.
Chemical Property Profile of 甲基苯基磷酸氢酯
Property Insights of 甲基苯基磷酸氢酯
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 甲基苯基磷酸氢酯. With a topological polar surface area (TPSA) of 55.8 Ų, 甲基苯基磷酸氢酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 甲基苯基磷酸氢酯 has 1 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 甲基苯基磷酸氢酯?
The CAS number of 甲基苯基磷酸氢酯 is 4009-39-6.
What is the molecular formula of 甲基苯基磷酸氢酯?
The molecular formula of 甲基苯基磷酸氢酯 is C7H9O4P.
What is the molecular weight of 甲基苯基磷酸氢酯?
The molecular weight of 甲基苯基磷酸氢酯 is 188.02 g/mol.
Where can I buy 甲基苯基磷酸氢酯?
You can request a quote for 甲基苯基磷酸氢酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 甲基苯基磷酸氢酯?
Yes, KEHONG BIO provides custom synthesis services for 甲基苯基磷酸氢酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.