[ethenyl(methyl)phosphoryl]oxycyclohexane

C9H17O2P — CID 66796538

IUPAC[ethenyl(methyl)phosphoryl]oxycyclohexane
SMILESC=CP(C)(=O)OC1CCCCC1
InChIInChI=1S/C9H17O2P/c1-3-12(2,10)11-9-7-5-4-6-8-9/h3,9H,1,4-8H2,2H3
InChIKeyMULGCQNVSATCSY-UHFFFAOYSA-N
MW188.21 g/mol
LogP3.39
Rot. Bonds3

About [ethenyl(methyl)phosphoryl]oxycyclohexane

[ethenyl(methyl)phosphoryl]oxycyclohexane (PubChem CID 66796538) has the molecular formula C9H17O2P and a molecular weight of 188.21 g/mol. Its IUPAC name is [ethenyl(methyl)phosphoryl]oxycyclohexane.

Molecular Properties

Compound Name[ethenyl(methyl)phosphoryl]oxycyclohexane
PubChem CID66796538
Molecular FormulaC9H17O2P
Molecular Weight188.21 g/mol
Exact Mass188.10
IUPAC Name[ethenyl(methyl)phosphoryl]oxycyclohexane
SMILESC=CP(C)(=O)OC1CCCCC1
InChIInChI=1S/C9H17O2P/c1-3-12(2,10)11-9-7-5-4-6-8-9/h3,9H,1,4-8H2,2H3
InChIKeyMULGCQNVSATCSY-UHFFFAOYSA-N
XLogP3.39
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.21
LogP ≤ 53.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [ethenyl(methyl)phosphoryl]oxycyclohexane?
The IUPAC name of [ethenyl(methyl)phosphoryl]oxycyclohexane (CID 66796538) is [ethenyl(methyl)phosphoryl]oxycyclohexane.
What is the SMILES notation for [ethenyl(methyl)phosphoryl]oxycyclohexane?
The canonical SMILES for [ethenyl(methyl)phosphoryl]oxycyclohexane is C=CP(C)(=O)OC1CCCCC1.
What is the InChIKey of [ethenyl(methyl)phosphoryl]oxycyclohexane?
The InChIKey is MULGCQNVSATCSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17O2P/c1-3-12(2,10)11-9-7-5-4-6-8-9/h3,9H,1,4-8H2,2H3.
What are the key properties of [ethenyl(methyl)phosphoryl]oxycyclohexane?
[ethenyl(methyl)phosphoryl]oxycyclohexane has a molecular weight of 188.21 g/mol, XLogP of 3.39, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [ethenyl(methyl)phosphoryl]oxycyclohexane is sourced from PubChem (CID 66796538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).