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Details

Stereochemistry ACHIRAL
Molecular Formula C13H18O
Molecular Weight 190.2814
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5'-Isopropyl-2'-methylpropiophenone

SMILES

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

InChI

InChIKey=ITZRSUKOUHROOX-UHFFFAOYSA-N
InChI=1S/C13H18O/c1-5-13(14)12-8-11(9(2)3)7-6-10(12)4/h6-9H,5H2,1-4H3

HIDE SMILES / InChI

Molecular Formula C13H18O
Molecular Weight 190.2814
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 Tue Apr 01 19:35:08 GMT 2025
Edited
by admin
on Tue Apr 01 19:35:08 GMT 2025
Record UNII
8GW9SN52VA
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5'-Isopropyl-2'-methylpropiophenone
Systematic Name English
1-(2-methyl-5-propan-2-ylphenyl)propan-1-one
Preferred Name English
1-[2-Methyl-5-(propan-2-yl)phenyl]propan-1-one
Systematic Name English
Propiophenone, 5?-isopropyl-2?-methyl-
Systematic Name English
1-[2-Methyl-5-(1-methylethyl)phenyl]-1-propanone
Systematic Name English
1-Propanone, 1-[2-methyl-5-(1-methylethyl)phenyl]-
Systematic Name English
Code System Code Type Description
CAS
84145-57-3
Created by admin on Tue Apr 01 19:35:08 GMT 2025 , Edited by admin on Tue Apr 01 19:35:08 GMT 2025
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FDA UNII
8GW9SN52VA
Created by admin on Tue Apr 01 19:35:08 GMT 2025 , Edited by admin on Tue Apr 01 19:35:08 GMT 2025
PRIMARY
PUBCHEM
19901204
Created by admin on Tue Apr 01 19:35:08 GMT 2025 , Edited by admin on Tue Apr 01 19:35:08 GMT 2025
PRIMARY
EPA CompTox
DTXSID30233061
Created by admin on Tue Apr 01 19:35:08 GMT 2025 , Edited by admin on Tue Apr 01 19:35:08 GMT 2025
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ECHA (EC/EINECS)
282-284-8
Created by admin on Tue Apr 01 19:35:08 GMT 2025 , Edited by admin on Tue Apr 01 19:35:08 GMT 2025
PRIMARY