ChemicalBook > CAS DataBase List > 2-(methylamino)-5-(methoxycarbonyl)-3-nitrobenzene

2-(methylamino)-5-(methoxycarbonyl)-3-nitrobenzene

Product Name
2-(methylamino)-5-(methoxycarbonyl)-3-nitrobenzene
CAS No.
36242-50-9
Chemical Name
2-(methylamino)-5-(methoxycarbonyl)-3-nitrobenzene
Synonyms
Dabigatran Impurity 87;methyl 3-nitro-N4-methylaminobenzoate;Methyl 4-(methylamino)-3-nitrobenzoate;2-(methylamino)-5-(methoxycarbonyl)-3-nitrobenzene;Benzoic acid, 4-(methylamino)-3-nitro-, methyl ester
CBNumber
CB22560294
Molecular Formula
C9H10N2O4
Formula Weight
210.19
MOL File
36242-50-9.mol
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2-(methylamino)-5-(methoxycarbonyl)-3-nitrobenzene Property

Melting point:
145 °C
Boiling point:
362.3±32.0 °C(Predicted)
Density 
1.325±0.06 g/cm3(Predicted)
storage temp. 
Keep in dark place,Inert atmosphere,Room temperature
pka
-2.72±0.25(Predicted)
Appearance
Yellow to brown Solid
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Safety

HS Code 
2918300090
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Hazard and Precautionary Statements (GHS)

Symbol(GHS)
Signal word
Warning
Hazard statements

H413May cause long lasting harmful effects to aquatic life

Precautionary statements

P273Avoid release to the environment.

P501Dispose of contents/container to..…

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N-Bromosuccinimide Price

TRC
Product number
M219230
Product name
Methyl4-(Methylamino)-3-nitrobenzoate
Packaging
100mg
Price
$75
Updated
2021/12/16
Apolloscientific
Product number
OR54327
Product name
Methyl4-(methylamino)-3-nitrobenzoate
Packaging
1g
Price
$41
Updated
2021/12/16
SynQuest Laboratories
Product number
4655-1-52
Product name
Methyl 4-(methylamino)-3-nitrobenzoate
Packaging
1g
Price
$45
Updated
2021/12/16
Apolloscientific
Product number
OR54327
Product name
Methyl4-(methylamino)-3-nitrobenzoate
Packaging
5g
Price
$115
Updated
2021/12/16
SynQuest Laboratories
Product number
4655-1-52
Product name
Methyl 4-(methylamino)-3-nitrobenzoate
Packaging
5G
Price
$127
Updated
2021/12/16
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2-(methylamino)-5-(methoxycarbonyl)-3-nitrobenzene Chemical Properties,Usage,Production

Synthesis

329-59-9

593-51-1

36242-50-9

To a stirred solution of methyl 4-fluoro-3-nitrobenzoate (CAS 329-59-9, 5.00 g, 25.1 mmol) in N,N-dimethylformamide (DMF, 50 mL) was sequentially added methylamine hydrochloride (2.00 g, 29.6 mmol) and potassium carbonate (4.50 g, 32.6 mmol). The reaction mixture was stirred at room temperature for 18 hours under nitrogen protection. Upon completion of the reaction, the crude product was concentrated under reduced pressure and the residue was extracted by partitioning with ethyl acetate (EtOAc, 350 mL) and aqueous 1N hydrochloric acid (250 mL). The organic layer was washed sequentially with aqueous 1N hydrochloric acid (150 mL) and saturated aqueous sodium chloride (100 mL). The organic layer was dried over anhydrous magnesium sulfate, filtered and concentrated under reduced pressure to give the yellow powdery product methyl 4-(methylamino)-3-nitrobenzoate (EV-AR3152-001, 5.30 g, quantitative yield).Results of LC-MS (Method D) analysis: retention time 1.07 min, m/z = 211 ([M+H]+).

References

[1] Patent: WO2017/100594, 2017, A1. Location in patent: Paragraph 00130
[2] Patent: WO2018/22897, 2018, A1. Location in patent: Paragraph 00126; 00127; 00128
[3] Patent: WO2017/147102, 2017, A1. Location in patent: Paragraph 00124-00125

2-(methylamino)-5-(methoxycarbonyl)-3-nitrobenzene Preparation Products And Raw materials

Raw materials

Preparation Products

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36242-50-9, 2-(methylamino)-5-(methoxycarbonyl)-3-nitrobenzeneRelated Search:


  • 2-(methylamino)-5-(methoxycarbonyl)-3-nitrobenzene
  • Methyl 4-(methylamino)-3-nitrobenzoate
  • Benzoic acid, 4-(methylamino)-3-nitro-, methyl ester
  • Dabigatran Impurity 87
  • methyl 3-nitro-N4-methylaminobenzoate
  • 36242-50-9