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Details

Stereochemistry ACHIRAL
Molecular Formula C8H7N
Molecular Weight 117.1479
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of P-TOLUNITRILE

SMILES

CC1=CC=C(C=C1)C#N

InChI

InChIKey=VCZNNAKNUVJVGX-UHFFFAOYSA-N
InChI=1S/C8H7N/c1-7-2-4-8(6-9)5-3-7/h2-5H,1H3

HIDE SMILES / InChI

Molecular Formula C8H7N
Molecular Weight 117.1479
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

PubMed

Substance Class Chemical
Record UNII
H20555V8NO
Record Status Validated (UNII)
Record Version