4?-(tert-Butyl)propiophenone

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NCATS

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?-(tert-Butyl)propiophenone

Structure Search

SMILES

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

InChI

InChIKey=AQNYEAINONORRY-UHFFFAOYSA-N

InChI=1S/C13H18O/c1-5-12(14)10-6-8-11(9-7-10)13(2,3)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 `Wed Apr 02 18:40:02 GMT 2025` Edited by `admin` on `Wed Apr 02 18:40:02 GMT 2025`
Record UNII	QUQ8K23G6T
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

4?-(tert-Butyl)propiophenone

Systematic Name

English

1-Propanone, 1-[4-(1,1-dimethylethyl)phenyl]-

Preferred Name

English

1-[4-(1,1-Dimethylethyl)phenyl]-1-propanone

Systematic Name

English

p-tert-Butylpropiophenone

Systematic Name

English

4?-tert-Butylpropiophenone

Systematic Name

English

Code System Code Type Description

ECHA (EC/EINECS)

275-265-0

Created by admin on Wed Apr 02 18:40:02 GMT 2025 , Edited by admin on Wed Apr 02 18:40:02 GMT 2025

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EPA CompTox

DTXSID50221405

Created by admin on Wed Apr 02 18:40:02 GMT 2025 , Edited by admin on Wed Apr 02 18:40:02 GMT 2025

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PUBCHEM

595281

Created by admin on Wed Apr 02 18:40:02 GMT 2025 , Edited by admin on Wed Apr 02 18:40:02 GMT 2025

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FDA UNII

QUQ8K23G6T

Created by admin on Wed Apr 02 18:40:02 GMT 2025 , Edited by admin on Wed Apr 02 18:40:02 GMT 2025

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CAS

71209-71-7

Created by admin on Wed Apr 02 18:40:02 GMT 2025 , Edited by admin on Wed Apr 02 18:40:02 GMT 2025

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