U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C5H9N
Molecular Weight 83.1317
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Pivalonitrile

SMILES

CC(C)(C)C#N

InChI

InChIKey=JAMNHZBIQDNHMM-UHFFFAOYSA-N
InChI=1S/C5H9N/c1-5(2,3)4-6/h1-3H3

HIDE SMILES / InChI

Molecular Formula C5H9N
Molecular Weight 83.1317
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Record UNII
AQD7ZXJ3PR
Record Status Validated (UNII)
Record Version