1-Bromo-3-iodobenzene

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C6H4BrI
Molecular Weight	282.904
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 1-Bromo-3-iodobenzene

Structure Search

SMILES

BrC1=CC=CC(I)=C1

InChI

InChIKey=CTPUUDQIXKUAMO-UHFFFAOYSA-N

InChI=1S/C6H4BrI/c7-5-2-1-3-6(8)4-5/h1-4H

HIDE SMILES / InChI

Molecular Formula	C6H4BrI
Molecular Weight	282.904
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 18:53:09 GMT 2025` Edited by `admin` on `Tue Apr 01 18:53:09 GMT 2025`
Record UNII	MQH7NC2UMH
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1-Bromo-3-iodobenzene

Systematic Name

English

Benzene, 1-bromo-3-iodo-

Preferred Name

English

1-Iodo-3-bromobenzene

Systematic Name

English

3-Bromo-1-iodobenzene

Systematic Name

English

Code System Code Type Description

FDA UNII

MQH7NC2UMH

Created by admin on Tue Apr 01 18:53:09 GMT 2025 , Edited by admin on Tue Apr 01 18:53:09 GMT 2025

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PUBCHEM

11561

Created by admin on Tue Apr 01 18:53:09 GMT 2025 , Edited by admin on Tue Apr 01 18:53:09 GMT 2025

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CAS

591-18-4

Created by admin on Tue Apr 01 18:53:09 GMT 2025 , Edited by admin on Tue Apr 01 18:53:09 GMT 2025

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ECHA (EC/EINECS)

209-703-9

Created by admin on Tue Apr 01 18:53:09 GMT 2025 , Edited by admin on Tue Apr 01 18:53:09 GMT 2025

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EPA CompTox

DTXSID9060447

Created by admin on Tue Apr 01 18:53:09 GMT 2025 , Edited by admin on Tue Apr 01 18:53:09 GMT 2025

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