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1,3-Dimethyl-4-nitro-1H-pyrazole-5-carbonitrile

1,3-Dimethyl-4-nitro-1H-pyrazole-5-carbonitrile structure

CAS No:
32183-13-4
Formula:
C6H6N4O2
Chemical Name:
1,3-Dimethyl-4-nitro-1H-pyrazole-5-carbonitrile
Synonyms:
1H-Pyrazole-5-carbonitrile,1,3-dimethyl-4-nitro-;Pyrazole-5-carbonitrile,1,3-dimethyl-4-nitro-;1,3-Dimethyl-4-nitro-1H-pyrazole-5-carbonitrile;1,3-Dimethyl-5-cyano-4-nitropyrazole;5-Cyano-1,3-dimethyl-4-nitropyrazole;NSC 77082

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1,3-Dimethyl-4-nitro-1H-pyrazole-5-carbonitrile Basic Attributes

Molecular Weight：

166.13700

Exact Mass：

166.14

EC Number：

250-946-5

NSC Number：

77082

DSSTox ID：

DTXSID40185961

HScode：

2933199090

Characteristics

PSA：

87.43000

XLogP3：

1.03158

Density：

1.42g/cm3

Melting Point：

92-93 °C

Boiling Point：

358.7ºC

Flash Point：

170.7ºC

Refractive Index：

1.637

Computed Properties

Molecular Weight:166.14
XLogP3:0.5
Hydrogen Bond Acceptor Count:4
Exact Mass:166.04907545
Monoisotopic Mass:166.04907545
Topological Polar Surface Area:87.4
Heavy Atom Count:12
Complexity:240
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1,3-Dimethyl-4-nitro-1H-pyrazole-5-carbonitrile

Basic Attributes
Characteristics
Computed Properties

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