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

Packsize	Purity	Availability	Price	Discounted Price
10g	95%	in stock	$13.00	$9.00
25g	95%	in stock	$27.00	$19.00
100g	95%	in stock	$66.00	$46.00

Description

• Catalog Number: AA33783
• 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

Computed Properties

• Complexity: 398
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 20
• Hydrogen Bond Acceptor Count: 6
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 1
• XLogP3: 3.7

Literature

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

  Acta crystallographica. Section E, Structure reports online 20120101