Home Halogens 5-Amino-1-(2,4,6-trichlorophenyl)-1H-pyrazole-4-carbonitrile

5-Amino-1-(2,4,6-trichlorophenyl)-1H-pyrazole-4-carbonitrile

CAS No.:
79002-96-3
Catalog Number:
AG005NSH
Molecular Formula:
C10H5Cl3N4
Molecular Weight:
287.5325
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
1 week
United States
$87
- +
1g
1 week
United States
$135
- +
5g
1 week
United States
$350
- +
Product Description
Catalog Number:
AG005NSH
Chemical Name:
5-Amino-1-(2,4,6-trichlorophenyl)-1H-pyrazole-4-carbonitrile
CAS Number:
79002-96-3
Molecular Formula:
C10H5Cl3N4
Molecular Weight:
287.5325
MDL Number:
MFCD03093789
IUPAC Name:
5-amino-1-(2,4,6-trichlorophenyl)pyrazole-4-carbonitrile
InChI:
InChI=1S/C10H5Cl3N4/c11-6-1-7(12)9(8(13)2-6)17-10(15)5(3-14)4-16-17/h1-2,4H,15H2
InChI Key:
XLVSDPGXTLGTAE-UHFFFAOYSA-N
SMILES:
N#Cc1cnn(c1N)c1c(Cl)cc(cc1Cl)Cl
Properties
Complexity:
319  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.958g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
287.528g/mol
Monoisotopic Mass:
285.958g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
67.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Properties