[ethyl(methyl)phosphoryl]oxycyclohexane

C9H19O2P — CID 66729701

IUPAC[ethyl(methyl)phosphoryl]oxycyclohexane
SMILESCCP(C)(=O)OC1CCCCC1
InChIInChI=1S/C9H19O2P/c1-3-12(2,10)11-9-7-5-4-6-8-9/h9H,3-8H2,1-2H3
InChIKeyFEIUQGMSHNYTFI-UHFFFAOYSA-N
MW190.22 g/mol
LogP3.26
Rot. Bonds3

About [ethyl(methyl)phosphoryl]oxycyclohexane

[ethyl(methyl)phosphoryl]oxycyclohexane (PubChem CID 66729701) has the molecular formula C9H19O2P and a molecular weight of 190.22 g/mol. Its IUPAC name is [ethyl(methyl)phosphoryl]oxycyclohexane.

Molecular Properties

Compound Name[ethyl(methyl)phosphoryl]oxycyclohexane
PubChem CID66729701
Molecular FormulaC9H19O2P
Molecular Weight190.22 g/mol
Exact Mass190.11
IUPAC Name[ethyl(methyl)phosphoryl]oxycyclohexane
SMILESCCP(C)(=O)OC1CCCCC1
InChIInChI=1S/C9H19O2P/c1-3-12(2,10)11-9-7-5-4-6-8-9/h9H,3-8H2,1-2H3
InChIKeyFEIUQGMSHNYTFI-UHFFFAOYSA-N
XLogP3.26
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.22
LogP ≤ 53.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

[fluoro(methyl)phosphoryl]oxycyclopentane;propane
CID 91381974
[fluoro(methyl)phosphoryl]oxycyclohexane
CID 14366907
[ethyl(methoxy)phosphoryl]oxycyclopentane
CID 87128122
tricyclooctyl phosphate
CID 22995283
[chloro(methyl)phosphoryl]oxycyclopentane
CID 170850792
cyclohexyl ethyl methyl phosphate
CID 66729683
cyclohexyloxy(dodecyl)phosphinic acid
CID 174792280
bis(dicyclohexyl phosphate);nickel(2+)
CID 22768614
azanide;cyclohexyloxy-[[cyclohexyloxy(hydroxy)phosphoryl]methyl]phosphinic acid;platinum(2+)
CID 58140306
[chloro-[dichloro-[chloro(cyclohexyloxy)phosphoryl]methyl]phosphoryl]oxycyclohexane
CID 87979264
[methyl(1,1,2,2,2-pentafluoroethoxy)phosphoryl]oxycyclohexane
CID 87127848
1-dicyclopentyloxyphosphorylbutan-1-one
CID 23002147

Frequently Asked Questions

What is the IUPAC name of [ethyl(methyl)phosphoryl]oxycyclohexane?
The IUPAC name of [ethyl(methyl)phosphoryl]oxycyclohexane (CID 66729701) is [ethyl(methyl)phosphoryl]oxycyclohexane.
What is the SMILES notation for [ethyl(methyl)phosphoryl]oxycyclohexane?
The canonical SMILES for [ethyl(methyl)phosphoryl]oxycyclohexane is CCP(C)(=O)OC1CCCCC1.
What is the InChIKey of [ethyl(methyl)phosphoryl]oxycyclohexane?
The InChIKey is FEIUQGMSHNYTFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19O2P/c1-3-12(2,10)11-9-7-5-4-6-8-9/h9H,3-8H2,1-2H3.
What are the key properties of [ethyl(methyl)phosphoryl]oxycyclohexane?
[ethyl(methyl)phosphoryl]oxycyclohexane has a molecular weight of 190.22 g/mol, XLogP of 3.26, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [ethyl(methyl)phosphoryl]oxycyclohexane is sourced from PubChem (CID 66729701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).