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Details

Stereochemistry ACHIRAL
Molecular Formula C14H20O
Molecular Weight 204.308
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-(4-Isobutylphenyl)-2-methylpropanal

SMILES

CC(C)CC1=CC=C(CC(C)C=O)C=C1

InChI

InChIKey=YLIXVKUWWOQREC-UHFFFAOYSA-N
InChI=1S/C14H20O/c1-11(2)8-13-4-6-14(7-5-13)9-12(3)10-15/h4-7,10-12H,8-9H2,1-3H3

HIDE SMILES / InChI

Approval Year

Name Type Language
3-(4-Isobutylphenyl)-2-methylpropanal
Systematic Name English
Benzenepropanal, ?-methyl-4-(2-methylpropyl)-
Preferred Name English
?-Methyl-4-(2-methylpropyl)benzenepropanal
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID4052346
Created by admin on Wed Apr 02 19:14:16 GMT 2025 , Edited by admin on Wed Apr 02 19:14:16 GMT 2025
PRIMARY
ECHA (EC/EINECS)
229-695-0
Created by admin on Wed Apr 02 19:14:16 GMT 2025 , Edited by admin on Wed Apr 02 19:14:16 GMT 2025
PRIMARY
CAS
6658-48-6
Created by admin on Wed Apr 02 19:14:16 GMT 2025 , Edited by admin on Wed Apr 02 19:14:16 GMT 2025
PRIMARY
PUBCHEM
110914
Created by admin on Wed Apr 02 19:14:16 GMT 2025 , Edited by admin on Wed Apr 02 19:14:16 GMT 2025
PRIMARY
FDA UNII
Z3NXK8Y7EX
Created by admin on Wed Apr 02 19:14:16 GMT 2025 , Edited by admin on Wed Apr 02 19:14:16 GMT 2025
PRIMARY