[fluoro(methyl)phosphoryl]oxycyclopentane;propane

C9H20FO2P — CID 91381974

IUPAC[fluoro(methyl)phosphoryl]oxycyclopentane;propane
SMILESCCC.CP(=O)(F)OC1CCCC1
InChIInChI=1S/C6H12FO2P.C3H8/c1-10(7,8)9-6-4-2-3-5-6;1-3-2/h6H,2-5H2,1H3;3H2,1-2H3
InChIKeyDMTCSOGEHVWYLQ-UHFFFAOYSA-N
MW210.23 g/mol
LogP4.15
Rot. Bonds2

About [fluoro(methyl)phosphoryl]oxycyclopentane;propane

[fluoro(methyl)phosphoryl]oxycyclopentane;propane (PubChem CID 91381974) has the molecular formula C9H20FO2P and a molecular weight of 210.23 g/mol. Its IUPAC name is [fluoro(methyl)phosphoryl]oxycyclopentane;propane.

Molecular Properties

Compound Name[fluoro(methyl)phosphoryl]oxycyclopentane;propane
PubChem CID91381974
Molecular FormulaC9H20FO2P
Molecular Weight210.23 g/mol
Exact Mass210.12
IUPAC Name[fluoro(methyl)phosphoryl]oxycyclopentane;propane
SMILESCCC.CP(=O)(F)OC1CCCC1
InChIInChI=1S/C6H12FO2P.C3H8/c1-10(7,8)9-6-4-2-3-5-6;1-3-2/h6H,2-5H2,1H3;3H2,1-2H3
InChIKeyDMTCSOGEHVWYLQ-UHFFFAOYSA-N
XLogP4.15
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.23
LogP ≤ 54.15
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]oxycyclohexane
CID 14366907
[ethyl(methyl)phosphoryl]oxycyclohexane
CID 66729701
[chloro(methyl)phosphoryl]oxycyclopentane
CID 170850792
[ethyl(methoxy)phosphoryl]oxycyclopentane
CID 87128122
tricyclooctyl phosphate
CID 22995283
cyclohexyl ethyl methyl phosphate
CID 66729683
[methyl(1,1,2,2,2-pentafluoroethoxy)phosphoryl]oxycyclohexane
CID 87127848
1-dicyclopentyloxyphosphorylbutan-1-one
CID 23002147
cyclopentyl fluoro methyl phosphate
CID 66729749
tricyclobutyl phosphate
CID 66609052
[methoxy(2,2,2-trifluoroethyl)phosphoryl]oxycyclohexane
CID 87128036
cyclohexyloxy(dodecyl)phosphinic acid
CID 174792280

Frequently Asked Questions

What is the IUPAC name of [fluoro(methyl)phosphoryl]oxycyclopentane;propane?
The IUPAC name of [fluoro(methyl)phosphoryl]oxycyclopentane;propane (CID 91381974) is [fluoro(methyl)phosphoryl]oxycyclopentane;propane.
What is the SMILES notation for [fluoro(methyl)phosphoryl]oxycyclopentane;propane?
The canonical SMILES for [fluoro(methyl)phosphoryl]oxycyclopentane;propane is CCC.CP(=O)(F)OC1CCCC1.
What is the InChIKey of [fluoro(methyl)phosphoryl]oxycyclopentane;propane?
The InChIKey is DMTCSOGEHVWYLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12FO2P.C3H8/c1-10(7,8)9-6-4-2-3-5-6;1-3-2/h6H,2-5H2,1H3;3H2,1-2H3.
What are the key properties of [fluoro(methyl)phosphoryl]oxycyclopentane;propane?
[fluoro(methyl)phosphoryl]oxycyclopentane;propane has a molecular weight of 210.23 g/mol, XLogP of 4.15, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [fluoro(methyl)phosphoryl]oxycyclopentane;propane is sourced from PubChem (CID 91381974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).