3-fluoro-5-(fluoromethyl)cyclopentene

C6H8F2 — CID 59893069

IUPAC3-fluoro-5-(fluoromethyl)cyclopentene
SMILESFCC1C=CC(F)C1
InChIInChI=1S/C6H8F2/c7-4-5-1-2-6(8)3-5/h1-2,5-6H,3-4H2
InChIKeyPCDSPRTYSRBTOS-UHFFFAOYSA-N
MW118.13 g/mol
LogP1.87
Rot. Bonds1

About 3-fluoro-5-(fluoromethyl)cyclopentene

3-fluoro-5-(fluoromethyl)cyclopentene (PubChem CID 59893069) has the molecular formula C6H8F2 and a molecular weight of 118.13 g/mol. Its IUPAC name is 3-fluoro-5-(fluoromethyl)cyclopentene.

Molecular Properties

Compound Name3-fluoro-5-(fluoromethyl)cyclopentene
PubChem CID59893069
Molecular FormulaC6H8F2
Molecular Weight118.13 g/mol
Exact Mass118.06
IUPAC Name3-fluoro-5-(fluoromethyl)cyclopentene
SMILESFCC1C=CC(F)C1
InChIInChI=1S/C6H8F2/c7-4-5-1-2-6(8)3-5/h1-2,5-6H,3-4H2
InChIKeyPCDSPRTYSRBTOS-UHFFFAOYSA-N
XLogP1.87
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.13
LogP ≤ 51.87
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-Methylcyclopentene
CID 14263
3,5-Dimethylcyclopentene
CID 522549
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
3-(2,2-Difluoroethenyl)cyclopentene
CID 134989112
(S)-3-Methylcyclopentene
CID 11018803
(r)-3-Methyl-cyclopentene
CID 11040623
(-)-(r)-3-Vinylcyclopenten
CID 97546577

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-5-(fluoromethyl)cyclopentene?
The IUPAC name of 3-fluoro-5-(fluoromethyl)cyclopentene (CID 59893069) is 3-fluoro-5-(fluoromethyl)cyclopentene.
What is the SMILES notation for 3-fluoro-5-(fluoromethyl)cyclopentene?
The canonical SMILES for 3-fluoro-5-(fluoromethyl)cyclopentene is FCC1C=CC(F)C1.
What is the InChIKey of 3-fluoro-5-(fluoromethyl)cyclopentene?
The InChIKey is PCDSPRTYSRBTOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8F2/c7-4-5-1-2-6(8)3-5/h1-2,5-6H,3-4H2.
What are the key properties of 3-fluoro-5-(fluoromethyl)cyclopentene?
3-fluoro-5-(fluoromethyl)cyclopentene has a molecular weight of 118.13 g/mol, XLogP of 1.87, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-5-(fluoromethyl)cyclopentene is sourced from PubChem (CID 59893069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).