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

Details

Stereochemistry ACHIRAL
Molecular Formula C9H10
Molecular Weight 118.1757
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of .BETA.-METHYLSTYRENE, CIS-

SMILES

C\C=C/C1=CC=CC=C1

InChI

InChIKey=QROGIFZRVHSFLM-KXFIGUGUSA-N
InChI=1S/C9H10/c1-2-6-9-7-4-3-5-8-9/h2-8H,1H3/b6-2-

HIDE SMILES / InChI

Molecular Formula C9H10
Molecular Weight 118.1757
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Record UNII
8NJI11T1B3
Record Status Validated (UNII)
Record Version