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196266

Sigma-Aldrich

2-(4-Chloro-3-nitrobenzoyl)benzoic acid

98%

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About This Item

Linear Formula:
ClC6H3(NO2)COC6H4CO2H
CAS Number:
Molecular Weight:
305.67
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22

Quality Level

Assay

98%

mp

198-201 °C (lit.)

SMILES string

OC(=O)c1ccccc1C(=O)c2ccc(Cl)c(c2)[N+]([O-])=O

InChI

1S/C14H8ClNO5/c15-11-6-5-8(7-12(11)16(20)21)13(17)9-3-1-2-4-10(9)14(18)19/h1-7H,(H,18,19)

InChI key

RITAQDHCJBLSSL-UHFFFAOYSA-N

General description

Reduction of 2-(4-chloro-3-nitrobenzoyl)benzoic acid in 5% NaOH aqueous solution in presence of Raney nickel, Pd/Al2O3 and Pt/Al2O3 has been investigated.

Application

2-(4-Chloro-3-nitrobenzoyl)benzoic acid has been used in the preparation of indanthrone derivatives.

Pictograms

Exclamation mark

Signal Word

Warning

Hazard Statements

Hazard Classifications

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

Target Organs

Respiratory system

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

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475. Chemistry of indanthrone. Part VI. Alkylsulphonyl-indanthrones.
Bradley W and Nursten HE.
Journal of the Chemical Society, 2177-2185 (1951)
Catalytic Liquid-Phase Reduction of Aromatic Nitro Compounds Containing Highly Reactive Functional Groups.
Zhandarev VV, et al.
Russ. J. Org. Chem., 37(5), 673-676 (2001)

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