4-Methoxy-3-nitrobenzonitrile
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4-Methoxy-3-nitrobenzonitrile
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CAS No:
33224-23-6
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Formula:
C8H6N2O3
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Chemical Name:
4-Methoxy-3-nitrobenzonitrile
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Synonyms:
Benzonitrile,4-methoxy-3-nitro-;p-Anisonitrile,3-nitro-;4-Methoxy-3-nitrobenzonitrile;5-Cyano-2-methoxynitrobenzene;3-Nitro-4-methoxybenzonitrile
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CAS No:
Characteristics
78.84000
1.99828
1.32±0.1 g/cm3
151 °C @ Solvent: Methanol
330.2±27.0 °C(Predicted)
153.5ºC
1.563
Computed Properties
Molecular Weight:178.14
XLogP3:1.5
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:178.03784206
Monoisotopic Mass:178.03784206
Topological Polar Surface Area:78.8
Heavy Atom Count:13
Complexity:240
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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