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(3-Allyl-)heptafluorobutan-2-one (HCID 22074693)|Huagongshe
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Compound
(3-Allyl-)heptafluorobutan-2-one
HCID
22074693
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Reactions
Basic information
Names & identifiers
Properties
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Compound notes
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Basic information
Standard SMILES
C=CCC(F)(C(=O)C(F)(F)F)C(F)(F)F
InChIKey
ZEGFYPJYMNVHGK-UHFFFAOYSA-N
Molecular formula
C7H5F7O
Average molar mass
238.1 g/mol
Names & identifiers
Preferred name
(3-Allyl-)heptafluorobutan-2-one
IUPAC
1,1,1,3-tetrafluoro-3-(trifluoromethyl)hex-5-en-2-one
Names & synonyms
SCHEMBL9184641
ZEGFYPJYMNVHGK-UHFFFAOYSA-N
(3-allyl-)heptafluorobutan-2-one
Database identifiers
PubChem CID
22074693
Properties
Computed structural properties
XLogP
3.5
Topological polar surface area
17.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
8
Rotatable bonds
3
Heavy atoms
15
Formal charge
0
Complexity
263
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Related reactions
2 records
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As reactant
As product
As reagent
As catalyst
As solvent
HRID
1033977
As product
uspto-grants-1994_05
HRID
1609146
As product
uspto-grants-1995_03
Compound notes
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