3-(2,2-difluoroethenyl)cyclopentene

C7H8F2 — CID 134989112

IUPAC3-(2,2-difluoroethenyl)cyclopentene
SMILESFC(F)=CC1C=CCC1
InChIInChI=1S/C7H8F2/c8-7(9)5-6-3-1-2-4-6/h1,3,5-6H,2,4H2
InChIKeyYKJGYTQKDPZCJW-UHFFFAOYSA-N
MW130.14 g/mol
LogP2.73
Rot. Bonds1

About 3-(2,2-difluoroethenyl)cyclopentene

3-(2,2-difluoroethenyl)cyclopentene (PubChem CID 134989112) has the molecular formula C7H8F2 and a molecular weight of 130.14 g/mol. Its IUPAC name is 3-(2,2-difluoroethenyl)cyclopentene.

Molecular Properties

Compound Name3-(2,2-difluoroethenyl)cyclopentene
PubChem CID134989112
Molecular FormulaC7H8F2
Molecular Weight130.14 g/mol
Exact Mass130.06
IUPAC Name3-(2,2-difluoroethenyl)cyclopentene
SMILESFC(F)=CC1C=CCC1
InChIInChI=1S/C7H8F2/c8-7(9)5-6-3-1-2-4-6/h1,3,5-6H,2,4H2
InChIKeyYKJGYTQKDPZCJW-UHFFFAOYSA-N
XLogP2.73
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.14
LogP ≤ 52.73
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-(Trifluoromethyl)cyclohexene
CID 15104043
(3R)-3-(trifluoromethyl)cyclohexene
CID 155430875
Cyclopentene, 3-ethenyl-
CID 556303
4,4-Difluoro-3-methylcyclopentene
CID 12757174
2,3-Di-fluorobicyclo[2.2.1]hepta-2,5-diene
CID 15129214
4-(2,2-Difluoroethenyl)cyclopentene
CID 134919912
(-)-(r)-3-Vinylcyclopenten
CID 97546577
3,3-Difluoro-5-methylcyclopentene
CID 12757173
4-(Difluoromethyl)cyclohexene
CID 13431156
3-(Difluoromethyl)cyclohexene
CID 23729724
(Z)-7,7,7-trifluoro-6-methylhept-2-ene
CID 56628094
4-Ethenyl-1,7-difluorohept-2-ene
CID 57172031

Frequently Asked Questions

What is the IUPAC name of 3-(2,2-difluoroethenyl)cyclopentene?
The IUPAC name of 3-(2,2-difluoroethenyl)cyclopentene (CID 134989112) is 3-(2,2-difluoroethenyl)cyclopentene.
What is the SMILES notation for 3-(2,2-difluoroethenyl)cyclopentene?
The canonical SMILES for 3-(2,2-difluoroethenyl)cyclopentene is FC(F)=CC1C=CCC1.
What is the InChIKey of 3-(2,2-difluoroethenyl)cyclopentene?
The InChIKey is YKJGYTQKDPZCJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8F2/c8-7(9)5-6-3-1-2-4-6/h1,3,5-6H,2,4H2.
What are the key properties of 3-(2,2-difluoroethenyl)cyclopentene?
3-(2,2-difluoroethenyl)cyclopentene has a molecular weight of 130.14 g/mol, XLogP of 2.73, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,2-difluoroethenyl)cyclopentene is sourced from PubChem (CID 134989112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).