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

Details

Stereochemistry ACHIRAL
Molecular Formula C8H10O
Molecular Weight 122.1644
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-METHOXY-3-METHYLBENZENE

SMILES

COC1=CC(C)=CC=C1

InChI

InChIKey=OSIGJGFTADMDOB-UHFFFAOYSA-N
InChI=1S/C8H10O/c1-7-4-3-5-8(6-7)9-2/h3-6H,1-2H3

HIDE SMILES / InChI

Molecular Formula C8H10O
Molecular Weight 122.1644
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
UI9I3Y6WTZ
Record Status Validated (UNII)
Record Version