4?-Bromobutyrophenone

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C10H11BrO
Molecular Weight	227.098
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4?-Bromobutyrophenone

Structure Search

SMILES

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

InChI

InChIKey=HOIDKJFWEVIJAT-UHFFFAOYSA-N

InChI=1S/C10H11BrO/c1-2-3-10(12)8-4-6-9(11)7-5-8/h4-7H,2-3H2,1H3

HIDE SMILES / InChI

Molecular Formula	C10H11BrO
Molecular Weight	227.098
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 17:41:33 GMT 2025` Edited by `admin` on `Tue Apr 01 17:41:33 GMT 2025`
Record UNII	EMU3AMT3NC
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

4?-Bromobutyrophenone

Systematic Name

English

NSC-76558

Preferred Name

English

1-Butanone, 1-(4-bromophenyl)-

Systematic Name

English

1-(4-Bromophenyl)-1-butanone

Systematic Name

English

Code System Code Type Description

ECHA (EC/EINECS)

225-632-6

Created by admin on Tue Apr 01 17:41:33 GMT 2025 , Edited by admin on Tue Apr 01 17:41:33 GMT 2025

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NSC

76558

Created by admin on Tue Apr 01 17:41:33 GMT 2025 , Edited by admin on Tue Apr 01 17:41:33 GMT 2025

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FDA UNII

EMU3AMT3NC

Created by admin on Tue Apr 01 17:41:33 GMT 2025 , Edited by admin on Tue Apr 01 17:41:33 GMT 2025

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CAS

4981-64-0

Created by admin on Tue Apr 01 17:41:33 GMT 2025 , Edited by admin on Tue Apr 01 17:41:33 GMT 2025

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PUBCHEM

78680

Created by admin on Tue Apr 01 17:41:33 GMT 2025 , Edited by admin on Tue Apr 01 17:41:33 GMT 2025

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EPA CompTox

DTXSID9063663

Created by admin on Tue Apr 01 17:41:33 GMT 2025 , Edited by admin on Tue Apr 01 17:41:33 GMT 2025

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