4,4,5,5,6,6,7,7,7-Nonafluoroheptanecarbonitrile

HCID 18546292
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Basic information

Standard SMILES
N#CCCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChIKey
YQZWIKSURCZSDR-UHFFFAOYSA-N
Molecular formula
C8H6F9N
Average molar mass
287.13 g/mol
Monoisotopic mass
287.03565265

Names & identifiers

Preferred name
4,4,5,5,6,6,7,7,7-Nonafluoroheptanecarbonitrile
IUPAC
5,5,6,6,7,7,8,8,8-nonafluorooctanenitrile

Names & synonyms

4,4,5,5,6,6,7,7,7-nonafluoroheptanecarbonitrileSCHEMBL7226896

Database identifiers

PubChem CID
18546292

Properties

Computed structural properties

XLogP
3.8
Topological polar surface area
23.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
10
Rotatable bonds
5
Heavy atoms
18

Related reactions

4 records
New reaction record

Compound notes

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