4'-BROMO-4-CHLOROBUTYROPHENONE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C10H10BrClO
Molecular Weight	261.543
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4'-BROMO-4-CHLOROBUTYROPHENONE

Structure Search

SMILES

ClCCCC(=O)C1=CC=C(Br)C=C1

InChI

InChIKey=WJKPUMBLABGUCQ-UHFFFAOYSA-N

InChI=1S/C10H10BrClO/c11-9-5-3-8(4-6-9)10(13)2-1-7-12/h3-6H,1-2,7H2

HIDE SMILES / InChI

Molecular Formula	C10H10BrClO
Molecular Weight	261.543
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 18:19:40 GMT 2025` Edited by `admin` on `Tue Apr 01 18:19:40 GMT 2025`
Record UNII	6D2RTW7CSC
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

4'-BROMO-4-CHLOROBUTYROPHENONE

Systematic Name

English

1-(4-BROMOPHENYL)-4-CHLORO-1-BUTANONE

Preferred Name

English

1-(4-BROMOPHENYL)-4-CHLOROBUTAN-1-ONE

Systematic Name

English

1-BUTANONE, 1-(4-BROMOPHENYL)-4-CHLORO-

Systematic Name

English

Code System Code Type Description

PUBCHEM

78317

Created by admin on Tue Apr 01 18:19:40 GMT 2025 , Edited by admin on Tue Apr 01 18:19:40 GMT 2025

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FDA UNII

6D2RTW7CSC

Created by admin on Tue Apr 01 18:19:40 GMT 2025 , Edited by admin on Tue Apr 01 18:19:40 GMT 2025

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CAS

4559-96-0

Created by admin on Tue Apr 01 18:19:40 GMT 2025 , Edited by admin on Tue Apr 01 18:19:40 GMT 2025

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ECHA (EC/EINECS)

224-930-3

Created by admin on Tue Apr 01 18:19:40 GMT 2025 , Edited by admin on Tue Apr 01 18:19:40 GMT 2025

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EPA CompTox

DTXSID00196558

Created by admin on Tue Apr 01 18:19:40 GMT 2025 , Edited by admin on Tue Apr 01 18:19:40 GMT 2025

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