[methoxy(methyl)phosphoryl]oxycyclohexane

C8H17O3P — CID 574009

IUPAC[methoxy(methyl)phosphoryl]oxycyclohexane
SMILESCOP(C)(=O)OC1CCCCC1
InChIInChI=1S/C8H17O3P/c1-10-12(2,9)11-8-6-4-3-5-7-8/h8H,3-7H2,1-2H3
InChIKeyUXITUBFQUAHYSL-UHFFFAOYSA-N
MW192.19 g/mol
LogP2.81
Rot. Bonds3

About [methoxy(methyl)phosphoryl]oxycyclohexane

[methoxy(methyl)phosphoryl]oxycyclohexane (PubChem CID 574009) has the molecular formula C8H17O3P and a molecular weight of 192.19 g/mol. Its IUPAC name is [methoxy(methyl)phosphoryl]oxycyclohexane.

Molecular Properties

Compound Name[methoxy(methyl)phosphoryl]oxycyclohexane
PubChem CID574009
Molecular FormulaC8H17O3P
Molecular Weight192.19 g/mol
Exact Mass192.09
IUPAC Name[methoxy(methyl)phosphoryl]oxycyclohexane
SMILESCOP(C)(=O)OC1CCCCC1
InChIInChI=1S/C8H17O3P/c1-10-12(2,9)11-8-6-4-3-5-7-8/h8H,3-7H2,1-2H3
InChIKeyUXITUBFQUAHYSL-UHFFFAOYSA-N
XLogP2.81
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.19
LogP ≤ 52.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

Analyze [methoxy(methyl)phosphoryl]oxycyclohexane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [methoxy(methyl)phosphoryl]oxycyclohexane?
The IUPAC name of [methoxy(methyl)phosphoryl]oxycyclohexane (CID 574009) is [methoxy(methyl)phosphoryl]oxycyclohexane.
What is the SMILES notation for [methoxy(methyl)phosphoryl]oxycyclohexane?
The canonical SMILES for [methoxy(methyl)phosphoryl]oxycyclohexane is COP(C)(=O)OC1CCCCC1.
What is the InChIKey of [methoxy(methyl)phosphoryl]oxycyclohexane?
The InChIKey is UXITUBFQUAHYSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17O3P/c1-10-12(2,9)11-8-6-4-3-5-7-8/h8H,3-7H2,1-2H3.
What are the key properties of [methoxy(methyl)phosphoryl]oxycyclohexane?
[methoxy(methyl)phosphoryl]oxycyclohexane has a molecular weight of 192.19 g/mol, XLogP of 2.81, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [methoxy(methyl)phosphoryl]oxycyclohexane is sourced from PubChem (CID 574009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).