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2,2,2-Trifluoro-1-(4-octylindolin-1-yl)ethanone (HCID 86661815)|Huagongshe
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Compound
2,2,2-Trifluoro-1-(4-octylindolin-1-yl)ethanone
HCID
86661815
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Basic information
Names & identifiers
Properties
Related reactions
Compound notes
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Basic information
Standard SMILES
CCCCCCCCc1cccc2c1CCN2C(=O)C(F)(F)F
InChIKey
LSBXJJQQLQGELW-UHFFFAOYSA-N
Molecular formula
C18H24F3NO
Average molar mass
327.4 g/mol
Names & identifiers
Preferred name
2,2,2-Trifluoro-1-(4-octylindolin-1-yl)ethanone
IUPAC
2,2,2-trifluoro-1-(4-octyl-2,3-dihydroindol-1-yl)ethanone
Names & synonyms
2,2,2-Trifluoro-1-(4-octylindolin-1-yl)ethanone
SCHEMBL566795
Database identifiers
PubChem CID
86661815
Properties
Computed structural properties
XLogP
6.5
Topological polar surface area
20.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
7
Heavy atoms
23
Formal charge
0
Complexity
383
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Related reactions
2 records
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As reactant
As product
As reagent
As catalyst
As solvent
HRID
710484
As product
uspto-grants-2015_11
HRID
710485
As reactant
uspto-grants-2015_11
Compound notes
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