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72910

4-Nitrobenzoic acid

Name: 4-Nitrobenzoic acid
Brand: SIAL

purum, ≥98.0% (HPLC)

Synonym(s):

p-Nitrobenzoic acid

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About This Item

Linear Formula:

O₂NC₆H₄CO₂H

CAS Number:

62-23-7

Molecular Weight:

167.12

UNSPSC Code:

12352100

NACRES:

NA.22

PubChem Substance ID:

329764455

EC Number:

200-526-2

Beilstein/REAXYS Number:

973593

MDL number:

MFCD00007352

Assay:

≥98.0% (HPLC)

Form:

crystals

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Properties

grade

purum

Quality Level

200

assay

≥98.0% (HPLC)

form

crystals

mp

237-240 °C (lit.), 239-242 °C

functional group

carboxylic acid, nitro

SMILES string

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

InChI

1S/C7H5NO4/c9-7(10)5-1-3-6(4-2-5)8(11)12/h1-4H,(H,9,10)

InChI key

OTLNPYWUJOZPPA-UHFFFAOYSA-N

Description

Application

4-Nitrobenzoic acid can be used:

As a co-catalyst with thioxotetrahydropyrimidinone for the α-alkylation of ketones.
For the synthesis of mononuclear zinc carboxylate complexes by reacting with zinc sulfate heptahydrate and NaOH.
As an additive in the room temperature catalytic Wittig reaction.

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pictograms

GHS08,GHS07

signalword

Warning

hcodes

H302,H315,H319,H341,H351,H361fd

pcodes

P202 - P264 - P301 + P312 - P302 + P352 - P305 + P351 + P338 - P308 + P313

Hazard Classifications

Acute Tox. 4 Oral - Carc. 2 - Eye Irrit. 2 - Muta. 2 - Repr. 2 - Skin Irrit. 2

Storage Class

13 - Non Combustible Solids

wgk

WGK 2

ppe

dust mask type N95 (US), Eyeshields, Gloves

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Synthesis and characterization of zinc benzoate complexes through combined solid and solution phase reactions.

Karmakar A and Baruah JB

Polyhedron, 27(17), 3409-3416 (2008)

Breaking the ring through a room temperature catalytic Wittig reaction.

O'Brien CJ, et al.

Chemistry?A European Journal , 19(19), 5854-5858 (2013)

Enantioselective Organocatalytic ?-Alkylation of Ketones by SN1-Type Reaction of Alcohols.

Trifonidou M and Kokotos CG

European Journal of Organic Chemistry, 2012(8), 1563-1568 (2012)

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Global Trade Item Number

SKU	GTIN
72910-50G	04061832862828
72910-1KG	04061825592985
72910-250G	04061832862774