428949

4-Methyl-3-nitrobenzoyl chloride

99%

• Synonim(y): 3-Nitro-p-toluoyl chloride
• Wzór liniowy: CH₃C₆H₃(NO₂)COCl
• Numer CAS: 10397-30-5
• Masa cząsteczkowa: 199.59
• NACRES: NA.22
• PubChem Substance ID: 24866825
• UNSPSC Code: 12352100
• EC Number: 233-858-1
• MDL number: MFCD00035747
• Assay: 99%
• Form: liquid

Właściwości

• assay: 99%
• form: liquid
• refractive index: n20/D 1.581 (lit.)
• bp: 185 °C/36 mmHg (lit.)
• mp: 20-21 °C (lit.)
• density: 1.37 g/mL at 25 °C (lit.)
• functional group: acyl chloride, nitro
• SMILES string: Cc1ccc(cc1[N+]([O-])=O)C(Cl)=O
• InChI: 1S/C8H6ClNO3/c1-5-2-3-6(8(9)11)4-7(5)10(12)13/h2-4H,1H3
• InChI key: DXMHBBURYDVYAI-UHFFFAOYSA-N

Opis

General description

4-Methyl-3-nitrobenzoyl chloride is a benzoyl chloride derivative. It has been reported to be synthesized from 4-methyl-3-nitrobenzoic acid.[1]

Application

4-Methyl-3-nitrobenzoyl chloride was used in the synthesis of 4-amino-1,5-naphthalenedisulphonate acid monosodium salt, an intermediate employed in the synthesis of modified suramin molecule.[2]
It may be used in the synthesis of the following:

• benzophenone derivative[3]
• substituted 3-amino-4-methyl-N-phenylbenzamide[4]
• retroamide[5]
• 4-methyl-3-nitro-N-phenylbenzamide[1]

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Informacja o środkach bezpieczeństwa

• pictograms: GHS05
• signalword: Danger
• hcodes: H314
• pcodes: P280 - P303 + P361 + P353 - P304 + P340 + P310 - P305 + P351 + P338 - P363 - P405
• Hazard Classifications: Eye Dam. 1 - Skin Corr. 1B
• Klasa składowania: 8A - Combustible corrosive hazardous materials
• wgk: WGK 3
• flash_point_f: 235.4 °F - closed cup
• flash_point_c: 113 °C - closed cup
• ppe: Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter