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2-Chloro-1-(3,5-Dimethyl-4-Nitro-1H-Pyrazol-1-Yl)Ethanone
[CAS# 514217-68-6]

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Identification
Name 2-Chloro-1-(3,5-Dimethyl-4-Nitro-1H-Pyrazol-1-Yl)Ethanone
Synonyms 1-(chloroacetyl)-4-nitro-3,5-dimethyl-1H-pyrazole; 2-chloro-1-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)ethanone; AK-968/40329540
Molecular Structure CAS#: 514217-68-6, 2-Chloro-1-(3,5-Dimethyl-4-Nitro-1H-Pyrazol-1-Yl)Ethanone
Molecular Formula C7H8ClN3O3
Molecular Weight 217.61
CAS Registry Number 514217-68-6
SMILES O=C(n1nc(c([N+]([O-])=O)c1C)C)CCl
InChI 1S/C7H8ClN3O3/c1-4-7(11(13)14)5(2)10(9-4)6(12)3-8/h3H2,1-2H3
InChIKey CQBQWELALFYZHY-UHFFFAOYSA-N
Properties
Density 1.527g/cm3 (Cal.)
Boiling point 354.033°C at 760 mmHg (Cal.)
Flash point 167.913°C (Cal.)
Refractive index 1.619 (Cal.)
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