7,7-difluorobicyclo[3.2.0]heptan-2-one

C7H8F2O — CID 14939334

IUPAC7,7-difluorobicyclo[3.2.0]heptan-2-one
SMILESO=C1CCC2CC(F)(F)C12
InChIInChI=1S/C7H8F2O/c8-7(9)3-4-1-2-5(10)6(4)7/h4,6H,1-3H2
InChIKeyFJTZIGNYUXTTJL-UHFFFAOYSA-N
MW146.14 g/mol
LogP1.62
Rot. Bonds

About 7,7-difluorobicyclo[3.2.0]heptan-2-one

7,7-difluorobicyclo[3.2.0]heptan-2-one (PubChem CID 14939334) has the molecular formula C7H8F2O and a molecular weight of 146.14 g/mol. Its IUPAC name is 7,7-difluorobicyclo[3.2.0]heptan-2-one.

Molecular Properties

Compound Name7,7-difluorobicyclo[3.2.0]heptan-2-one
PubChem CID14939334
Molecular FormulaC7H8F2O
Molecular Weight146.14 g/mol
Exact Mass146.05
IUPAC Name7,7-difluorobicyclo[3.2.0]heptan-2-one
SMILESO=C1CCC2CC(F)(F)C12
InChIInChI=1S/C7H8F2O/c8-7(9)3-4-1-2-5(10)6(4)7/h4,6H,1-3H2
InChIKeyFJTZIGNYUXTTJL-UHFFFAOYSA-N
XLogP1.62
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.14
LogP ≤ 51.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 7,7-difluorobicyclo[3.2.0]heptan-2-one?
The IUPAC name of 7,7-difluorobicyclo[3.2.0]heptan-2-one (CID 14939334) is 7,7-difluorobicyclo[3.2.0]heptan-2-one.
What is the SMILES notation for 7,7-difluorobicyclo[3.2.0]heptan-2-one?
The canonical SMILES for 7,7-difluorobicyclo[3.2.0]heptan-2-one is O=C1CCC2CC(F)(F)C12.
What is the InChIKey of 7,7-difluorobicyclo[3.2.0]heptan-2-one?
The InChIKey is FJTZIGNYUXTTJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8F2O/c8-7(9)3-4-1-2-5(10)6(4)7/h4,6H,1-3H2.
What are the key properties of 7,7-difluorobicyclo[3.2.0]heptan-2-one?
7,7-difluorobicyclo[3.2.0]heptan-2-one has a molecular weight of 146.14 g/mol, XLogP of 1.62, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7,7-difluorobicyclo[3.2.0]heptan-2-one is sourced from PubChem (CID 14939334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).