2,5-difluorobicyclo[2.2.2]oct-2-ene

C8H10F2 — CID 137445692

IUPAC2,5-difluorobicyclo[2.2.2]oct-2-ene
SMILESFC1=CC2CCC1CC2F
InChIInChI=1S/C8H10F2/c9-7-4-6-2-1-5(7)3-8(6)10/h3,5-7H,1-2,4H2
InChIKeyRIDWQIWACCBZMP-UHFFFAOYSA-N
MW144.16 g/mol
LogP2.61
Rot. Bonds

About 2,5-difluorobicyclo[2.2.2]oct-2-ene

2,5-difluorobicyclo[2.2.2]oct-2-ene (PubChem CID 137445692) has the molecular formula C8H10F2 and a molecular weight of 144.16 g/mol. Its IUPAC name is 2,5-difluorobicyclo[2.2.2]oct-2-ene.

Molecular Properties

Compound Name2,5-difluorobicyclo[2.2.2]oct-2-ene
PubChem CID137445692
Molecular FormulaC8H10F2
Molecular Weight144.16 g/mol
Exact Mass144.08
IUPAC Name2,5-difluorobicyclo[2.2.2]oct-2-ene
SMILESFC1=CC2CCC1CC2F
InChIInChI=1S/C8H10F2/c9-7-4-6-2-1-5(7)3-8(6)10/h3,5-7H,1-2,4H2
InChIKeyRIDWQIWACCBZMP-UHFFFAOYSA-N
XLogP2.61
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.16
LogP ≤ 52.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2,5-difluorobicyclo[2.2.2]oct-2-ene?
The IUPAC name of 2,5-difluorobicyclo[2.2.2]oct-2-ene (CID 137445692) is 2,5-difluorobicyclo[2.2.2]oct-2-ene.
What is the SMILES notation for 2,5-difluorobicyclo[2.2.2]oct-2-ene?
The canonical SMILES for 2,5-difluorobicyclo[2.2.2]oct-2-ene is FC1=CC2CCC1CC2F.
What is the InChIKey of 2,5-difluorobicyclo[2.2.2]oct-2-ene?
The InChIKey is RIDWQIWACCBZMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10F2/c9-7-4-6-2-1-5(7)3-8(6)10/h3,5-7H,1-2,4H2.
What are the key properties of 2,5-difluorobicyclo[2.2.2]oct-2-ene?
2,5-difluorobicyclo[2.2.2]oct-2-ene has a molecular weight of 144.16 g/mol, XLogP of 2.61, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-difluorobicyclo[2.2.2]oct-2-ene is sourced from PubChem (CID 137445692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).