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87412-96-2

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87412-96-2 Structure

87412-96-2 Structure
IdentificationBack Directory
[Name]

1H-Pyrazole-4-carbonitrile,1,3-dimethyl-(9CI)
[CAS]

87412-96-2
[Synonyms]

1,3-dimethyl-4-pyrazolecarbonitrile
1,3-dimethylpyrazole-4-carbonitrile
1H-Pyrazole-4-carbonitrile, 1,3-diMethyl-
1H-Pyrazole-4-carbonitrile,1,3-dimethyl-(9CI)
[Molecular Formula]

C6H7N3
[MDL Number]

MFCD04969706
[MOL File]

87412-96-2.mol
[Molecular Weight]

121.14
Chemical PropertiesBack Directory
[Boiling point ]

239.8±20.0 °C(Predicted)
[density ]

1.09±0.1 g/cm3(Predicted)
[storage temp. ]

2-8°C
[form ]

solid
[pka]

-0.94±0.10(Predicted)
[InChI]

1S/C6H7N3/c1-5-6(3-7)4-9(2)8-5/h4H,1-2H3
[InChIKey]

XOFOOXWGRXHZKD-UHFFFAOYSA-N
[SMILES]

Cc1nn(C)cc1C#N
Safety DataBack Directory
[WGK Germany ]

WGK 3
[Storage Class]

11 - Combustible Solids
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