Dicyclohexyl methylphosphonate
TL;DR: Dicyclohexyl methylphosphonate (CAS 7040-53-1) is a chemical compound with molecular formula C13H25O3P and molecular weight 260.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[cyclohexyloxy(methyl)phosphoryl]oxycyclohexane
Also Known As: Dicyclohexyl methylphosphonate, Methylphosphonic acid, dicyclohexyl ester, Methylphosphonic acid dicyclohexyl ester, Phosphonic acid, methyl-, dicyclohexyl ester, [cyclohexyloxy(methyl)phosphoryl]oxycyclohexane
| Molecular Formula | C13H25O3P |
|---|---|
| Molecular Weight | 260.15 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 260.15414 |
| Heavy Atoms | 17 |
| Complexity | 244.0 |
Chemical Identifiers
| CAS Number | 7040-53-1 |
|---|---|
| SMILES | CP(=O)(OC1CCCCC1)OC2CCCCC2 |
| InChIKey | RNXRKONDANQYCR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dicyclohexyl methylphosphonate (CAS 7040-53-1), with molecular formula C13H25O3P and molecular weight 260.15 g/mol. IUPAC: [cyclohexyloxy(methyl)phosphoryl]oxycyclohexane.
Chemical Property Profile of Dicyclohexyl methylphosphonate
Property Insights of Dicyclohexyl methylphosphonate
The XLogP value of 3.1 indicates that Dicyclohexyl methylphosphonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, Dicyclohexyl methylphosphonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dicyclohexyl methylphosphonate has 0 hydrogen bond donor(s) and 3 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 Dicyclohexyl methylphosphonate?
The CAS number of Dicyclohexyl methylphosphonate is 7040-53-1.
What is the molecular formula of Dicyclohexyl methylphosphonate?
The molecular formula of Dicyclohexyl methylphosphonate is C13H25O3P.
What is the molecular weight of Dicyclohexyl methylphosphonate?
The molecular weight of Dicyclohexyl methylphosphonate is 260.15 g/mol.
Where can I buy Dicyclohexyl methylphosphonate?
You can request a quote for Dicyclohexyl methylphosphonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dicyclohexyl methylphosphonate?
Yes, KEHONG BIO provides custom synthesis services for Dicyclohexyl methylphosphonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.