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Details

Stereochemistry RACEMIC
Molecular Formula C13H18O
Molecular Weight 190.2814
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ISOPROPYLPHENYLBUTANAL

SMILES

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

InChI

InChIKey=OHRBQTOZYGEWCJ-UHFFFAOYSA-N
InChI=1S/C13H18O/c1-10(2)12-5-4-6-13(9-12)11(3)7-8-14/h4-6,8-11H,7H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C13H18O
Molecular Weight 190.2814
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 01:54:16 GMT 2023
Edited
by admin
on Sat Dec 16 01:54:16 GMT 2023
Record UNII
Z92022479Y
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ISOPROPYLPHENYLBUTANAL
INCI  
INCI  
Official Name English
3-(3-ISOPROPYLPHENYL)BUTANAL
Systematic Name English
FLORHYDRAL
Common Name English
BENZENEPROPANAL, .BETA.-METHYL-3-(1-METHYLETHYL)-
Systematic Name English
(±)-ISOPROPYLPHENYLBUTANAL
Systematic Name English
.BETA.-METHYL-3-(1-METHYLETHYL)BENZENEPROPANAL
Systematic Name English
ISOPROPYLPHENYLBUTANAL, (±)-
Systematic Name English
ISOPROPYLPHENYLBUTANAL [INCI]
Common Name English
Code System Code Type Description
FDA UNII
Z92022479Y
Created by admin on Sat Dec 16 01:54:16 GMT 2023 , Edited by admin on Sat Dec 16 01:54:16 GMT 2023
PRIMARY
CAS
125109-85-5
Created by admin on Sat Dec 16 01:54:16 GMT 2023 , Edited by admin on Sat Dec 16 01:54:16 GMT 2023
PRIMARY
EPA CompTox
DTXSID7051632
Created by admin on Sat Dec 16 01:54:16 GMT 2023 , Edited by admin on Sat Dec 16 01:54:16 GMT 2023
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DAILYMED
Z92022479Y
Created by admin on Sat Dec 16 01:54:16 GMT 2023 , Edited by admin on Sat Dec 16 01:54:16 GMT 2023
PRIMARY
RXCUI
2383935
Created by admin on Sat Dec 16 01:54:16 GMT 2023 , Edited by admin on Sat Dec 16 01:54:16 GMT 2023
PRIMARY
PUBCHEM
86209
Created by admin on Sat Dec 16 01:54:16 GMT 2023 , Edited by admin on Sat Dec 16 01:54:16 GMT 2023
PRIMARY