2-(cyclohexen-1-yl)-2-fluoro-1,4-dioxane

C10H15FO2 — CID 57233955

IUPAC2-(cyclohexen-1-yl)-2-fluoro-1,4-dioxane
SMILESFC1(C2=CCCCC2)COCCO1
InChIInChI=1S/C10H15FO2/c11-10(8-12-6-7-13-10)9-4-2-1-3-5-9/h4H,1-3,5-8H2
InChIKeyWDYLBKMMMLYOAF-UHFFFAOYSA-N
MW186.23 g/mol
LogP2.20
Rot. Bonds1

About 2-(cyclohexen-1-yl)-2-fluoro-1,4-dioxane

2-(cyclohexen-1-yl)-2-fluoro-1,4-dioxane (PubChem CID 57233955) has the molecular formula C10H15FO2 and a molecular weight of 186.23 g/mol. Its IUPAC name is 2-(cyclohexen-1-yl)-2-fluoro-1,4-dioxane.

Molecular Properties

Compound Name2-(cyclohexen-1-yl)-2-fluoro-1,4-dioxane
PubChem CID57233955
Molecular FormulaC10H15FO2
Molecular Weight186.23 g/mol
Exact Mass186.11
IUPAC Name2-(cyclohexen-1-yl)-2-fluoro-1,4-dioxane
SMILESFC1(C2=CCCCC2)COCCO1
InChIInChI=1S/C10H15FO2/c11-10(8-12-6-7-13-10)9-4-2-1-3-5-9/h4H,1-3,5-8H2
InChIKeyWDYLBKMMMLYOAF-UHFFFAOYSA-N
XLogP2.20
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.23
LogP ≤ 52.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1,4-Difluoro-2-[2-(4-methylcyclohex-3-en-1-yl)oxyethoxymethyl]cyclohexene
CID 69626908
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CID 118422677
6-fluoro-2-(oxiran-2-yl)-3,4,8,8a-tetrahydro-2H-chromene
CID 123196114
6-fluoro-2-(oxiran-2-yl)-3,4,6,7,8,8a-hexahydro-2H-chromene
CID 161901591
6-fluoro-2-propyl-3,4,6,7,8,8a-hexahydro-2H-chromene
CID 163646733
7-Methylene-9-oxa-bicyclo[3.3.1]non-2-ene
CID 549015
2-(Cyclohexen-1-yl)-1,4-dioxane
CID 57296326
2-(oxan-2-yl)-3,6-dihydro-2H-pyran
CID 67511787
(2R)-2-(cyclohexen-1-ylmethoxymethyl)oxane
CID 126666979
(2S)-2-(cyclohexen-1-ylmethoxymethyl)oxane
CID 126667359
2-(Cyclohexen-1-ylmethoxymethyl)oxane
CID 126667406
6-Methyl-2,3,4a,7,8,8a-hexahydro-1,4-benzodioxine
CID 143520605

Frequently Asked Questions

What is the IUPAC name of 2-(cyclohexen-1-yl)-2-fluoro-1,4-dioxane?
The IUPAC name of 2-(cyclohexen-1-yl)-2-fluoro-1,4-dioxane (CID 57233955) is 2-(cyclohexen-1-yl)-2-fluoro-1,4-dioxane.
What is the SMILES notation for 2-(cyclohexen-1-yl)-2-fluoro-1,4-dioxane?
The canonical SMILES for 2-(cyclohexen-1-yl)-2-fluoro-1,4-dioxane is FC1(C2=CCCCC2)COCCO1.
What is the InChIKey of 2-(cyclohexen-1-yl)-2-fluoro-1,4-dioxane?
The InChIKey is WDYLBKMMMLYOAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15FO2/c11-10(8-12-6-7-13-10)9-4-2-1-3-5-9/h4H,1-3,5-8H2.
What are the key properties of 2-(cyclohexen-1-yl)-2-fluoro-1,4-dioxane?
2-(cyclohexen-1-yl)-2-fluoro-1,4-dioxane has a molecular weight of 186.23 g/mol, XLogP of 2.20, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclohexen-1-yl)-2-fluoro-1,4-dioxane is sourced from PubChem (CID 57233955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).