2-(1-Methylethyl)-5,9,13-trimethyl-2,4,8,12-tetradecatetraenenitrile

HCID 53657145

Basic information

Standard SMILES
CC(C)=CCCC(C)=CCCC(C)=CC=C(C#N)C(C)C
InChIKey
AQROFDJIBGKDOT-UHFFFAOYSA-N
Molecular formula
C20H31N
Average molar mass
285.5 g/mol

Names & identifiers

Preferred name
2-(1-Methylethyl)-5,9,13-trimethyl-2,4,8,12-tetradecatetraenenitrile
IUPAC
5,9,13-trimethyl-2-propan-2-yltetradeca-2,4,8,12-tetraenenitrile

Names & synonyms

SCHEMBL9421372AQROFDJIBGKDOT-UHFFFAOYSA-N2 -(1-methylethyl)-5,9,13-trimethyl-2,4,8,12-tetradecatetraenenitrile2-(1-methylethyl)-5,9,13-trimethyl-2,4,8,12-tetradecatetraenenitrile

Database identifiers

PubChem CID
53657145

Properties

Computed structural properties

XLogP
6.9
Topological polar surface area
23.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
8
Heavy atoms
21

Related reactions

15 records

Linked notes

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