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Methyl [1-adamantyloxy(methoxy)phosphoryl]formate
TL;DR: Methyl [1-adamantyloxy(methoxy)phosphoryl]formate (CAS 72304-89-3) is a chemical compound with molecular formula C13H21O5P and molecular weight 288.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl [1-adamantyloxy(methoxy)phosphoryl]formate
Also Known As: methyl [1-adamantyloxy(methoxy)phosphoryl]formate, methyl (1-adamantyloxy)(methoxy)phosphinecarboxylate oxide, Phosphinecarboxylic acid, methoxy(tricyclo(3.3.1.1(3,7))dec-1-yloxy)-, methyl ester, oxide, Methyl [(adamantan-1-yl)oxy](methoxy)(oxo)-lambda~5~-phosphanecarboxylate, Methyl [(adamantan-1-yl)oxy](methoxy)oxo-lambda~5~-phosphanecarboxylate
| Molecular Formula | C13H21O5P |
|---|---|
| Molecular Weight | 288.11 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 61.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 288.11267 |
| Heavy Atoms | 19 |
| Complexity | 391.0 |
Chemical Identifiers
| CAS Number | 72304-89-3 |
|---|---|
| SMILES | COC(=O)P(=O)(OC)OC12CC3CC(C1)CC(C3)C2 |
| InChIKey | YYWJIOYRAZIVMY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl [1-adamantyloxy(methoxy)phosphoryl]formate (CAS 72304-89-3), with molecular formula C13H21O5P and molecular weight 288.11 g/mol. IUPAC: methyl [1-adamantyloxy(methoxy)phosphoryl]formate.
Chemical Property Profile of Methyl [1-adamantyloxy(methoxy)phosphoryl]formate
Property Insights of Methyl [1-adamantyloxy(methoxy)phosphoryl]formate
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl [1-adamantyloxy(methoxy)phosphoryl]formate. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl [1-adamantyloxy(methoxy)phosphoryl]formate. Following Lipinski's Rule of Five, Methyl [1-adamantyloxy(methoxy)phosphoryl]formate 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 Methyl [1-adamantyloxy(methoxy)phosphoryl]formate?
The CAS number of Methyl [1-adamantyloxy(methoxy)phosphoryl]formate is 72304-89-3.
What is the molecular formula of Methyl [1-adamantyloxy(methoxy)phosphoryl]formate?
The molecular formula of Methyl [1-adamantyloxy(methoxy)phosphoryl]formate is C13H21O5P.
What is the molecular weight of Methyl [1-adamantyloxy(methoxy)phosphoryl]formate?
The molecular weight of Methyl [1-adamantyloxy(methoxy)phosphoryl]formate is 288.11 g/mol.
Where can I buy Methyl [1-adamantyloxy(methoxy)phosphoryl]formate?
You can request a quote for Methyl [1-adamantyloxy(methoxy)phosphoryl]formate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl [1-adamantyloxy(methoxy)phosphoryl]formate?
Yes, KEHONG BIO provides custom synthesis services for Methyl [1-adamantyloxy(methoxy)phosphoryl]formate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.