Catalog No.:AA000Q57

120068-79-3 | 5-Amino-1-(2,6-dichloro-4-trifluoromethylphenyl)-3-cycano pyrazole

Name: Name:5-Amino-1-(2,6-dichloro-4-trifluoromethylphenyl)-3-cycano pyrazole
Brand: AABLOCKS
SKU: AA000Q57
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10g

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Technical Information
Properties
Downstream Synthesis Route
Literature
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Technical Information
Properties
Downstream Synthesis Route
Literature

Technical Information

Catalog Number:

AA000Q57

Chemical Name:

5-Amino-1-(2,6-dichloro-4-trifluoromethylphenyl)-3-cycano pyrazole

CAS Number:

120068-79-3

Molecular Formula:

C11H5Cl2F3N4

Molecular Weight:

321.0854

MDL Number:

MFCD00227537

SMILES:

N#Cc1nn(c(c1)N)c1c(Cl)cc(cc1Cl)C(F)(F)F

Properties

Form:

Solid

MP:

117 - 118 °C

Storage:

Inert atmosphere;2-8℃;

Computed Properties

Complexity:

398

Covalently-Bonded Unit Count:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Rotatable Bond Count:

XLogP3:

3.7

Downstream Synthesis Route

120068-79-3

5-amino-4-chloro-1-(2,6-dichloro-4-trifluoromethyl-phenyl)-1<i>H</i>-pyrazole-3-carbonitrile

[1]BioorganicandMedicinalChemistry,2004,vol.12,p.3345-3355

120068-79-3

3-cyano-4-bromo-5-amino-1-(2,6-dichloro-4-trifluoromethylphenyl)-1H-pyrazole

[1]BioorganicandMedicinalChemistry,2004,vol.12,p.3345-3355

120068-79-3

5-amino-3-cyano-1-(2,6-dichloro-4-trifluoromethylphenyl)-4-ethylpyrazole

[1]JournalofAgriculturalandFoodChemistry,2003,vol.51,p.7055-7061

120068-79-3

188539-05-1

[1]JournalofAgriculturalandFoodChemistry,2003,vol.51,p.7055-7061

120068-79-3

120068-36-2

[1]ChemicalResearchinToxicology,1998,vol.11,p.1529-1535

Literature

Title: 2-Chloro-N-{3-cyano-1-[2,6-dichloro-4-(trifluoro-meth-yl)phen-yl]-1H-pyrazol-5-yl}acetamide.

Journal: Acta crystallographica. Section E, Structure reports online 20120101

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SDS