ChemicalBook Product Catalog Chemical Reagents Organic reagents Nitro compounds Methyl 4-nitrobenzoate

Methyl 4-nitrobenzoate

Methyl 4-nitrobenzoate Basic information
Product Name:Methyl 4-nitrobenzoate
Synonyms:p-carbomethoxynitrobenzene;p-Nitrobenzoic acid methyl ester;METHYL 4-NITROBENZOATE;4-nitro-benzoicacimethylester;Benzoic acid, 4-nitro-, methyl ester;Benzoic acid, p-nitro-, methyl ester;Benzoicacid,4-nitro-,methylester;Methyl ester of 4-Nitrobenzoic acid
CAS:619-50-1
MF:C8H7NO4
MW:181.15
EINECS:210-599-2
Product Categories:Building Blocks;C8 to C9;Aromatic Esters;Carbonyl Compounds;Chemical Synthesis;Organic Building Blocks;C8 to C9;Carbonyl Compounds;Esters
Mol File:619-50-1.mol
Methyl 4-nitrobenzoate Structure
Methyl 4-nitrobenzoate Chemical Properties
Melting point 94-96 °C (lit.) 94-96 °C
Boiling point 314.24°C (rough estimate)
density 1.4283 (rough estimate)
refractive index 1.5468 (estimate)
Fp 94-96°C
storage temp. Sealed in dry,Room Temperature
solubility Solubility in methanol is almost transparent.
form powder to crystal
color Light orange to Yellow to Green
BRN 1912198
CAS DataBase Reference619-50-1(CAS DataBase Reference)
NIST Chemistry Reference4-Nitrobenzoic acid methyl ester(619-50-1)
EPA Substance Registry SystemMethyl-4-nitrobenzoate (619-50-1)
Safety Information
Safety Statements 22-24/25
WGK Germany 3
RTECS DH5775000
TSCA Yes
HS Code 29163900
MSDS Information
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Methyl 4-nitrobenzoate English
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Methyl 4-nitrobenzoate Usage And Synthesis
Chemical Propertieslight yellow to yellow fine crystalline powder
UsesIt is employed in the biochemical characterization of NfsA, the Escherichia coli major nitroreductase exhibiting a high amino acid sequence homology to Frp, a Vibrio harveyi flavin oxidoreductase.
Synthesis Reference(s)The Journal of Organic Chemistry, 60, p. 1466, 1995 DOI: 10.1021/jo00110a059
Purification MethodsDissolve the benzoate in diethyl ether, then wash it with aqueous alkali; the ether is evaporated and the ester is recrystallised from EtOH. [Beilstein 9 H 390, 9 IV 1074.]
Methyl 4-nitrobenzoate Preparation Products And Raw materials
Raw materialsp-Nitrobenzoic acid
Preparation ProductsMethyl 3-methyl-4-nitrobenzoate-->METHYL 2-CHLORO-4-NITROBENZOATE-->METHYL 2-BROMO-4-NITROBENZOATE-->ISOPROPYL 4-AMINOBENZOATE
Methylparaben Methyl anthranilate Methyl 4-(4-NITROBENZOYLOXY)-2,2,6,6-TETRAMETHYL-1-PIPERIDINYLOXY 4-Nitrobenzonitrile Methyl 4-nitrobenzoate Parathion-methyl 4-Nitrobenzoic Acid Isooctyl Ester 4-Nitrophthalic anhydride Kresoxim-methyl 3-methyl-,4-nitrobenzoate,(r)-oxiranemethan 4-Nitrobenzaldehyde Methyl benzoate Methyl acrylate Methyl 3-hydroxy-4-nitrobenzoate Methyl formate Methyl acetate Methyl bromide
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