4-BROMO-3-NITROTOLUENE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C7H6BrNO2
Molecular Weight	216.032
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4-BROMO-3-NITROTOLUENE

Structure Search

SMILES

CC1=CC=C(Br)C(=C1)[N+]([O-])=O

InChI

InChIKey=UPBUTKQMDPHQAQ-UHFFFAOYSA-N

InChI=1S/C7H6BrNO2/c1-5-2-3-6(8)7(4-5)9(10)11/h2-4H,1H3

HIDE SMILES / InChI

Molecular Formula	C7H6BrNO2
Molecular Weight	216.032
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 11:51:55 GMT 2025` Edited by `admin` on `Wed Apr 02 11:51:55 GMT 2025`
Record UNII	MG8CU54QET
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

4-BROMO-3-NITROTOLUENE

Systematic Name

English

NSC-289

Preferred Name

English

1-BROMO-4-METHYL-2-NITROBENZENE

Common Name

English

BENZENE, 1-BROMO-4-METHYL-2-NITRO-

Systematic Name

English

TOLUENE, 4-BROMO-3-NITRO-

Systematic Name

English

2-BROMO-5-METHYLNITROBENZENE

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID00201378

Created by admin on Wed Apr 02 11:51:55 GMT 2025 , Edited by admin on Wed Apr 02 11:51:55 GMT 2025

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FDA UNII

MG8CU54QET

Created by admin on Wed Apr 02 11:51:55 GMT 2025 , Edited by admin on Wed Apr 02 11:51:55 GMT 2025

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NSC

289

Created by admin on Wed Apr 02 11:51:55 GMT 2025 , Edited by admin on Wed Apr 02 11:51:55 GMT 2025

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ECHA (EC/EINECS)

226-203-6

Created by admin on Wed Apr 02 11:51:55 GMT 2025 , Edited by admin on Wed Apr 02 11:51:55 GMT 2025

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PUBCHEM

79224

Created by admin on Wed Apr 02 11:51:55 GMT 2025 , Edited by admin on Wed Apr 02 11:51:55 GMT 2025

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CAS

5326-34-1

Created by admin on Wed Apr 02 11:51:55 GMT 2025 , Edited by admin on Wed Apr 02 11:51:55 GMT 2025

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