2-Ethyl-5,5,6,6,6-pentafluoro-2-(3,3,3-trifluoropropylsulfonyl)hexanenitrile

HCID 57788356
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Basic information

Standard SMILES
CCC(C#N)(CCC(F)(F)C(F)(F)F)S(=O)(=O)CCC(F)(F)F
InChIKey
CQUWCAOVSDFXIU-UHFFFAOYSA-N
Molecular formula
C11H13F8NO2S
Average molar mass
375.28 g/mol

Names & identifiers

Preferred name
2-Ethyl-5,5,6,6,6-pentafluoro-2-(3,3,3-trifluoropropylsulfonyl)hexanenitrile
IUPAC
2-ethyl-5,5,6,6,6-pentafluoro-2-(3,3,3-trifluoropropylsulfonyl)hexanenitrile

Names & synonyms

SCHEMBL2428721CQUWCAOVSDFXIU-UHFFFAOYSA-N2-ethyl-5,5,6,6,6-pentafluoro-2-(3,3,3-trifluoropropylsulfonyl)hexanenitrile

Database identifiers

PubChem CID
57788356

Properties

Computed structural properties

XLogP
4.1
Topological polar surface area
66.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
11
Rotatable bonds
7
Heavy atoms
23

Related reactions

1 records
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Compound notes

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