2-(3,3,4,4,4-Pentafluorobutyl)-2-(3,3,3-trifluoropropylsulfonyl)heptanenitrile

HCID 57788442
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Basic information

Standard SMILES
CCCCCC(C#N)(CCC(F)(F)C(F)(F)F)S(=O)(=O)CCC(F)(F)F
InChIKey
JUZLISVKQIXTED-UHFFFAOYSA-N
Molecular formula
C14H19F8NO2S
Average molar mass
417.36 g/mol

Names & identifiers

Preferred name
2-(3,3,4,4,4-Pentafluorobutyl)-2-(3,3,3-trifluoropropylsulfonyl)heptanenitrile
IUPAC
2-(3,3,4,4,4-pentafluorobutyl)-2-(3,3,3-trifluoropropylsulfonyl)heptanenitrile

Names & synonyms

SCHEMBL2429791JUZLISVKQIXTED-UHFFFAOYSA-N2-(3,3,4,4,4-pentafluorobutyl)-2-(3,3,3-trifluoropropylsulfonyl)heptanenitrile

Database identifiers

PubChem CID
57788442

Properties

Computed structural properties

XLogP
5.5
Topological polar surface area
66.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
11
Rotatable bonds
10
Heavy atoms
26

Related reactions

1 records
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Compound notes

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