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Details

Stereochemistry ACHIRAL
Molecular Formula C12H14O2
Molecular Weight 190.2384
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-(4-Acetylphenyl)-2-methyl-1-propanone

SMILES

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

InChI

InChIKey=OKDVJTURSCLUBA-UHFFFAOYSA-N
InChI=1S/C12H14O2/c1-8(2)12(14)11-6-4-10(5-7-11)9(3)13/h4-8H,1-3H3

HIDE SMILES / InChI

Molecular Formula C12H14O2
Molecular Weight 190.2384
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 Wed Apr 02 13:17:25 GMT 2025
Edited
by admin
on Wed Apr 02 13:17:25 GMT 2025
Record UNII
ZEN7L2XC8B
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-(4-Acetylphenyl)-2-methyl-1-propanone
Common Name English
1-Propanone, 1-(4-acetylphenyl)-2-methyl-
Preferred Name English
Code System Code Type Description
PUBCHEM
15206077
Created by admin on Wed Apr 02 13:17:25 GMT 2025 , Edited by admin on Wed Apr 02 13:17:25 GMT 2025
PRIMARY
CAS
103931-20-0
Created by admin on Wed Apr 02 13:17:25 GMT 2025 , Edited by admin on Wed Apr 02 13:17:25 GMT 2025
PRIMARY
EPA CompTox
DTXSID10569991
Created by admin on Wed Apr 02 13:17:25 GMT 2025 , Edited by admin on Wed Apr 02 13:17:25 GMT 2025
PRIMARY
FDA UNII
ZEN7L2XC8B
Created by admin on Wed Apr 02 13:17:25 GMT 2025 , Edited by admin on Wed Apr 02 13:17:25 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> IMPURITY