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

Details

Stereochemistry ACHIRAL
Molecular Formula C10H12O
Molecular Weight 148.2017
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3,4-DIMETHYLACETOPHENONE

SMILES

CC(=O)C1=CC(C)=C(C)C=C1

InChI

InChIKey=WPRAXAOJIODQJR-UHFFFAOYSA-N
InChI=1S/C10H12O/c1-7-4-5-10(9(3)11)6-8(7)2/h4-6H,1-3H3

HIDE SMILES / InChI

Molecular Formula C10H12O
Molecular Weight 148.2017
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 19:13:43 GMT 2025
Edited
by admin
on Mon Mar 31 19:13:43 GMT 2025
Record UNII
PC1L145T5V
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3,4-DIMETHYLACETOPHENONE
Common Name English
1-(3,4-DIMETHYLPHENYL)ETHANONE
Preferred Name English
ETHANONE, 1-(3,4-DIMETHYLPHENYL)-
Systematic Name English
METHYL 3,4-DIMETHYLPHENYL KETONE
Systematic Name English
3',4'-DIMETHYLACETOPHENONE
Systematic Name English
ACETOPHENONE, 3',4'-DIMETHYL-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID0063109
Created by admin on Mon Mar 31 19:13:43 GMT 2025 , Edited by admin on Mon Mar 31 19:13:43 GMT 2025
PRIMARY
CAS
3637-01-2
Created by admin on Mon Mar 31 19:13:43 GMT 2025 , Edited by admin on Mon Mar 31 19:13:43 GMT 2025
PRIMARY
ECHA (EC/EINECS)
222-859-2
Created by admin on Mon Mar 31 19:13:43 GMT 2025 , Edited by admin on Mon Mar 31 19:13:43 GMT 2025
PRIMARY
FDA UNII
PC1L145T5V
Created by admin on Mon Mar 31 19:13:43 GMT 2025 , Edited by admin on Mon Mar 31 19:13:43 GMT 2025
PRIMARY
PUBCHEM
77193
Created by admin on Mon Mar 31 19:13:43 GMT 2025 , Edited by admin on Mon Mar 31 19:13:43 GMT 2025
PRIMARY