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664855

4-Bromo-2-nitrobenzoic acid

97%

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About This Item

Linear Formula:
(Br)C6H3(NO2)CO2H
CAS Number:
99277-71-1
Molecular Weight:
246.01
NACRES:
NA.22
PubChem Substance ID:
24884696
UNSPSC Code:
12352100
MDL number:
MFCD01013599
Assay:
97%
Form:
solid
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assay

97%

form

solid

mp

165-169 °C

functional group

bromo, carboxylic acid, nitro

SMILES string

OC(=O)c1ccc(Br)cc1[N+]([O-])=O

InChI

1S/C7H4BrNO4/c8-4-1-2-5(7(10)11)6(3-4)9(12)13/h1-3H,(H,10,11)

InChI key

ZIRHHEZLJGORGU-UHFFFAOYSA-N

Application

Undergoes Negishi-type coupling with dimethylzinc in the presence of palladium-phosphine catalysis.

pictograms

Exclamation markEnvironment
GHS07,GHS09

signalword

Warning

Hazard Classifications

Acute Tox. 4 Oral - Aquatic Acute 1 - Eye Irrit. 2 - Skin Irrit. 2 - Skin Sens. 1 - STOT SE 3

target_organs

Respiratory system

Storage Class

11 - Combustible Solids

wgk

WGK 2

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Faceshields, Gloves

Regulatory Information

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Certificates of Analysis (COA)

Lot/Batch Number
MKCV0487
MKCJ3518
MKBT6175V
MKBK6359V
MKBH4271V

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Tetrahedron Letters, 45, 817-817 (2004)

Global Trade Item Number

SKUGTIN
664855-5G04061831822922
664855-1G04061825587608