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1-(5-Ethenyl-2-bicyclo[2.2.1]heptanyl)-2,2,2-trifluoroethanone

HCID 178531007
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Basic information

CAS
424826-75-5
Standard SMILES
C=CC1CC2CC1CC2C(=O)C(F)(F)F
InChIKey
JQVCERHYMCFUCB-UHFFFAOYSA-N
Molecular formula
C11H13F3O
Average molar mass
218.21 g/mol

Names & identifiers

Preferred name
1-(5-Ethenyl-2-bicyclo[2.2.1]heptanyl)-2,2,2-trifluoroethanone
IUPAC
1-(5-ethenyl-2-bicyclo[2.2.1]heptanyl)-2,2,2-trifluoroethanone
English name
Ethanone, 1-(5-ethenylbicyclo[2.2.1]hept-2-yl)-2,2,2-trifluoro- (9CI)
Molecular formula
C11H13F3O
Molecular weight
218.2155296

Names & synonyms

424826-75-5DB-287110ETHANONE, 1-(5-ETHENYLBICYCLO[2.2.1]HEPT-2-YL)-2,2,2-TRIFLUORO-Ethanone, 1-(5-ethenylbicyclo[2.2.1]hept-2-yl)-2,2,2-trifluoro- (9CI)

Database identifiers

CAS
424826-75-5

Properties

Computed structural properties

XLogP
3.4
Topological polar surface area
17.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
2
Heavy atoms
15
Formal charge
0
Complexity
295

Chemistry & industry

Suppliers1 total

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Compound notes

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