methyl4-nitro-1H-pyrrole-2-carboxylate
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methyl4-nitro-1H-pyrrole-2-carboxylate
structure -
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CAS No:
13138-74-4
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Formula:
C6H6N2O4
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Chemical Name:
methyl4-nitro-1H-pyrrole-2-carboxylate
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Synonyms:
4-Nitropyrrole-2-carboxylic Acid Methyl Ester;2-(Methoxycarbonyl)-4-nitro-1H-pyrrole;1H-Pyrrole-2-carboxylic acid, 4-nitro-, Methyl ester;methyl 4-nitro-1H-pyrrole-2-carboxylate;4-nitro-1H-pyrrole-2-carboxylic acid methyl ester;Methyl4-nitropyrrole-2-carboxylate,95%
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CAS No:
methyl4-nitro-1H-pyrrole-2-carboxylate Basic Attributes
170.12
170.03275668 g/mol
94955
DTXSID00294169
2933990090
Characteristics
87.91000
1.23270
1.447±0.06 g/cm3
192-193°
342.2±22.0 °C(Predicted)
160.7ºC
1.578
7.67E-05mmHg at 25°C
12.12±0.50
Computed Properties
Molecular Weight:170.12
XLogP3:0.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:170.03275668
Monoisotopic Mass:170.03275668
Topological Polar Surface Area:87.9
Heavy Atom Count:12
Complexity:200
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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