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275883

3-Chloro-2-nitrobenzoic acid

Name: 3-Chloro-2-nitrobenzoic acid
Brand: ALDRICH

97%

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About This Item

Linear Formula:

ClC₆H₃(NO₂)CO₂H

CAS Number:

4771-47-5

Molecular Weight:

201.56

UNSPSC Code:

12352100

NACRES:

NA.22

PubChem Substance ID:

24856678

EC Number:

225-313-1

Beilstein/REAXYS Number:

2109828

MDL number:

MFCD00007087

Assay:

97%

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Properties

assay

97%

mp

237-239 °C (lit.)

functional group

carboxylic acid, nitro

SMILES string

OC(=O)c1cccc(Cl)c1[N+]([O-])=O

InChI

1S/C7H4ClNO4/c8-5-3-1-2-4(7(10)11)6(5)9(12)13/h1-3H,(H,10,11)

InChI key

VCHSXYHBMFKRBK-UHFFFAOYSA-N

Description

General description

Hydrogen-bonded structures of isomeric compounds of 3-chloro-2-nitrobenzoic acid with quinoline have been investigated.

Application

3-Chloro-2-nitrobenzoic acid has been used in the preparation of:

2-amino-3-chlorobenzonitrile
3-chloro-2-nitrobenzaldehyde

pictograms

GHS07

signalword

Warning

hcodes

H315,H319,H335

pcodes

P261 - P264 - P271 - P280 - P302 + P352 - P305 + P351 + P338

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Gloves

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