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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 4?-Isobutylpropiophenone

SMILES

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

InChI

InChIKey=GPZIKPBHFMNTOH-UHFFFAOYSA-N
InChI=1S/C13H18O/c1-4-13(14)12-7-5-11(6-8-12)9-10(2)3/h5-8,10H,4,9H2,1-3H3

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 19:11:39 GMT 2025
Edited
by admin
on Tue Apr 01 19:11:39 GMT 2025
Record UNII
3WN2T72W9V
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
p-Isobutylpropiophenone
Preferred Name English
4?-Isobutylpropiophenone
Systematic Name English
1-[4-(2-Methylpropyl)phenyl]-1-propanone
Systematic Name English
1-Propanone, 1-[4-(2-methylpropyl)phenyl]-
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
261-922-9
Created by admin on Tue Apr 01 19:11:39 GMT 2025 , Edited by admin on Tue Apr 01 19:11:39 GMT 2025
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FDA UNII
3WN2T72W9V
Created by admin on Tue Apr 01 19:11:39 GMT 2025 , Edited by admin on Tue Apr 01 19:11:39 GMT 2025
PRIMARY
EPA CompTox
DTXSID40208503
Created by admin on Tue Apr 01 19:11:39 GMT 2025 , Edited by admin on Tue Apr 01 19:11:39 GMT 2025
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PUBCHEM
108834
Created by admin on Tue Apr 01 19:11:39 GMT 2025 , Edited by admin on Tue Apr 01 19:11:39 GMT 2025
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CAS
59771-24-3
Created by admin on Tue Apr 01 19:11:39 GMT 2025 , Edited by admin on Tue Apr 01 19:11:39 GMT 2025
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