2-ISOPROPYL-3-METHYLBUTYROPHENONE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C14H20O
Molecular Weight	204.308
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2-ISOPROPYL-3-METHYLBUTYROPHENONE

Structure Search

SMILES

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

InChI

InChIKey=FYQORWFOIQDIHG-UHFFFAOYSA-N

InChI=1S/C14H20O/c1-10(2)13(11(3)4)14(15)12-8-6-5-7-9-12/h5-11,13H,1-4H3

HIDE SMILES / InChI

Molecular Formula	C14H20O
Molecular Weight	204.308
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 `Mon Mar 31 22:26:56 GMT 2025` Edited by `admin` on `Mon Mar 31 22:26:56 GMT 2025`
Record UNII	P3MEU5J4BP
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2-ISOPROPYL-3-METHYLBUTYROPHENONE

Systematic Name

English

1-BUTANONE, 3-METHYL-2-(1-METHYLETHYL)-1-PHENYL-

Preferred Name

English

3-METHYL-2-(1-METHYLETHYL)-1-PHENYL-1-BUTANONE

Systematic Name

English

3-METHYL-1-PHENYL-2-(PROPAN-2-YL)BUTAN-1-ONE

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID6068648

Created by admin on Mon Mar 31 22:26:56 GMT 2025 , Edited by admin on Mon Mar 31 22:26:56 GMT 2025

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CAS

51556-30-0

Created by admin on Mon Mar 31 22:26:56 GMT 2025 , Edited by admin on Mon Mar 31 22:26:56 GMT 2025

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PUBCHEM

103904

Created by admin on Mon Mar 31 22:26:56 GMT 2025 , Edited by admin on Mon Mar 31 22:26:56 GMT 2025

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FDA UNII

P3MEU5J4BP

Created by admin on Mon Mar 31 22:26:56 GMT 2025 , Edited by admin on Mon Mar 31 22:26:56 GMT 2025

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ECHA (EC/EINECS)

257-283-0

Created by admin on Mon Mar 31 22:26:56 GMT 2025 , Edited by admin on Mon Mar 31 22:26:56 GMT 2025

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