[(Z)-6-cyclohexyl-3,4-difluorohex-3-enyl]cyclohexane

C18H30F2 — CID 101427944

IUPAC[(Z)-6-cyclohexyl-3,4-difluorohex-3-enyl]cyclohexane
SMILESF/C(CCC1CCCCC1)=C(\F)CCC1CCCCC1
InChIInChI=1S/C18H30F2/c19-17(13-11-15-7-3-1-4-8-15)18(20)14-12-16-9-5-2-6-10-16/h15-16H,1-14H2/b18-17-
InChIKeyKUWSEYZAMIDQJU-ZCXUNETKSA-N
MW284.43 g/mol
LogP6.86
Rot. Bonds6

About [(Z)-6-cyclohexyl-3,4-difluorohex-3-enyl]cyclohexane

[(Z)-6-cyclohexyl-3,4-difluorohex-3-enyl]cyclohexane (PubChem CID 101427944) has the molecular formula C18H30F2 and a molecular weight of 284.43 g/mol. Its IUPAC name is [(Z)-6-cyclohexyl-3,4-difluorohex-3-enyl]cyclohexane.

Molecular Properties

Compound Name[(Z)-6-cyclohexyl-3,4-difluorohex-3-enyl]cyclohexane
PubChem CID101427944
Molecular FormulaC18H30F2
Molecular Weight284.43 g/mol
Exact Mass284.23
IUPAC Name[(Z)-6-cyclohexyl-3,4-difluorohex-3-enyl]cyclohexane
SMILESF/C(CCC1CCCCC1)=C(\F)CCC1CCCCC1
InChIInChI=1S/C18H30F2/c19-17(13-11-15-7-3-1-4-8-15)18(20)14-12-16-9-5-2-6-10-16/h15-16H,1-14H2/b18-17-
InChIKeyKUWSEYZAMIDQJU-ZCXUNETKSA-N
XLogP6.86
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500284.43
LogP ≤ 56.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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2-fluoroethylcyclodecane
CID 70177675
3-cyclohexadecylpropylcyclohexadecane
CID 57270632
4-cyclopentylbutylcyclohexane
CID 144547696
4-cyclohexyl-2-oxobutanamide
CID 69253318
1-cyclohexylhexan-3-one
CID 10856142
3-cyclohexylpropanoic acid;ethane;propane
CID 169257090
3-cyclohexylpropanamide;ethane;methanamine
CID 178116013
3-cyclobutylpropylcyclohexane
CID 54165208
calcium;3-cyclopentylpropanoic acid;hydride
CID 173013179
3-cyclopentylpropanimidamide
CID 83681795

Frequently Asked Questions

What is the IUPAC name of [(Z)-6-cyclohexyl-3,4-difluorohex-3-enyl]cyclohexane?
The IUPAC name of [(Z)-6-cyclohexyl-3,4-difluorohex-3-enyl]cyclohexane (CID 101427944) is [(Z)-6-cyclohexyl-3,4-difluorohex-3-enyl]cyclohexane.
What is the SMILES notation for [(Z)-6-cyclohexyl-3,4-difluorohex-3-enyl]cyclohexane?
The canonical SMILES for [(Z)-6-cyclohexyl-3,4-difluorohex-3-enyl]cyclohexane is F/C(CCC1CCCCC1)=C(\F)CCC1CCCCC1.
What is the InChIKey of [(Z)-6-cyclohexyl-3,4-difluorohex-3-enyl]cyclohexane?
The InChIKey is KUWSEYZAMIDQJU-ZCXUNETKSA-N. The full InChI is InChI=1S/C18H30F2/c19-17(13-11-15-7-3-1-4-8-15)18(20)14-12-16-9-5-2-6-10-16/h15-16H,1-14H2/b18-17-.
What are the key properties of [(Z)-6-cyclohexyl-3,4-difluorohex-3-enyl]cyclohexane?
[(Z)-6-cyclohexyl-3,4-difluorohex-3-enyl]cyclohexane has a molecular weight of 284.43 g/mol, XLogP of 6.86, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-6-cyclohexyl-3,4-difluorohex-3-enyl]cyclohexane is sourced from PubChem (CID 101427944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).