2-(tert-Butyl)isonicotinonitrile

HCID 693322
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Basic information

Standard SMILES
CC(C)(C)c1cc(C#N)ccn1
InChIKey
CJAKCVBSWSUUHM-UHFFFAOYSA-N
Molecular formula
C10H12N2
Average molar mass
160.22 g/mol

Names & identifiers

Preferred name
2-(tert-Butyl)isonicotinonitrile
IUPAC
2-tert-butylpyridine-4-carbonitrile

Names & synonyms

33538-09-92-tert-butylpyridine-4-carbonitrile2-(tert-Butyl)isonicotinonitrile2-tert-butylisonicotinonitrileMFCD049715452-tert-Butyl-isonicotinonitrile2-(tert-butyl)pyridine-4-carbonitrile2-tert-Butyl-4-cyanopyridineSCHEMBL2739654CJAKCVBSWSUUHM-UHFFFAOYSA-NSBB087455AKOS000320634
Show more names
CS-W000641AS-43800DA-06739SY0681122-(2-Methyl-2-propanyl)isonicotinonitrileAS-871/43475907F316847

Database identifiers

PubChem CID
693322
Nikkaji
J247.535I

Properties

Computed structural properties

XLogP
2.1
Topological polar surface area
36.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
12

Related reactions

2 records
New reaction record

Compound notes

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