7-ethenyl-2,2-difluorospiro[3.5]nonane

C11H16F2 — CID 178020956

IUPAC7-ethenyl-2,2-difluorospiro[3.5]nonane
SMILESC=CC1CCC2(CC1)CC(F)(F)C2
InChIInChI=1S/C11H16F2/c1-2-9-3-5-10(6-4-9)7-11(12,13)8-10/h2,9H,1,3-8H2
InChIKeyKOLDFDQVKMCPSS-UHFFFAOYSA-N
MW186.24 g/mol
LogP3.78
Rot. Bonds1

About 7-ethenyl-2,2-difluorospiro[3.5]nonane

7-ethenyl-2,2-difluorospiro[3.5]nonane (PubChem CID 178020956) has the molecular formula C11H16F2 and a molecular weight of 186.24 g/mol. Its IUPAC name is 7-ethenyl-2,2-difluorospiro[3.5]nonane.

Molecular Properties

Compound Name7-ethenyl-2,2-difluorospiro[3.5]nonane
PubChem CID178020956
Molecular FormulaC11H16F2
Molecular Weight186.24 g/mol
Exact Mass186.12
IUPAC Name7-ethenyl-2,2-difluorospiro[3.5]nonane
SMILESC=CC1CCC2(CC1)CC(F)(F)C2
InChIInChI=1S/C11H16F2/c1-2-9-3-5-10(6-4-9)7-11(12,13)8-10/h2,9H,1,3-8H2
InChIKeyKOLDFDQVKMCPSS-UHFFFAOYSA-N
XLogP3.78
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.24
LogP ≤ 53.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

3,9-bis(ethenyl)-2,4-dioxaspiro[5.5]undecane
CID 66977326
9-(4-ethenylcyclohexyl)-3,4-difluorospiro[5.5]undecane
CID 89276700
3-ethenyl-1,6-dimethylbicyclo[4.2.1]nonane
CID 163966943
ethenylcyclononane
CID 123465789
ethenylcyclotetradecane
CID 123915888
4-ethenyl-1-(1-methoxyethoxy)-1-(trifluoromethyl)cyclohexane
CID 23405324
1,1-difluoro-4-propa-1,2-dienylcyclohexane
CID 174809330
6-(4,4-difluorocyclohexyl)-2,2-difluorospiro[3.3]heptane
CID 178021651
ethane;ethene;1-ethenyl-4-methylcyclohexane
CID 142074855
4-ethenyl-1-(1-ethoxyethoxy)-1-(trifluoromethyl)cyclohexane
CID 23405320
1-ethenyl-4-[1-(4-ethenylcyclohexyl)ethyl]cyclohexane
CID 153439228
4-ethenylcyclohexane-1-carbaldehyde
CID 15509286

Frequently Asked Questions

What is the IUPAC name of 7-ethenyl-2,2-difluorospiro[3.5]nonane?
The IUPAC name of 7-ethenyl-2,2-difluorospiro[3.5]nonane (CID 178020956) is 7-ethenyl-2,2-difluorospiro[3.5]nonane.
What is the SMILES notation for 7-ethenyl-2,2-difluorospiro[3.5]nonane?
The canonical SMILES for 7-ethenyl-2,2-difluorospiro[3.5]nonane is C=CC1CCC2(CC1)CC(F)(F)C2.
What is the InChIKey of 7-ethenyl-2,2-difluorospiro[3.5]nonane?
The InChIKey is KOLDFDQVKMCPSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16F2/c1-2-9-3-5-10(6-4-9)7-11(12,13)8-10/h2,9H,1,3-8H2.
What are the key properties of 7-ethenyl-2,2-difluorospiro[3.5]nonane?
7-ethenyl-2,2-difluorospiro[3.5]nonane has a molecular weight of 186.24 g/mol, XLogP of 3.78, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethenyl-2,2-difluorospiro[3.5]nonane is sourced from PubChem (CID 178020956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).