Home Nitros 3-Bromo-1-(4-nitrophenyl)-1h-1,2,4-triazole

3-Bromo-1-(4-nitrophenyl)-1h-1,2,4-triazole

CAS No.:
1129540-71-1
Catalog Number:
AG00HCGD
Molecular Formula:
C8H5BrN4O2
Molecular Weight:
269.0549
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
1 week
United States
$264
- +
1g
97%
1 week
United States
$603
- +
Product Description
Catalog Number:
AG00HCGD
Chemical Name:
3-Bromo-1-(4-nitrophenyl)-1h-1,2,4-triazole
CAS Number:
1129540-71-1
Molecular Formula:
C8H5BrN4O2
Molecular Weight:
269.0549
MDL Number:
MFCD15525417
IUPAC Name:
3-bromo-1-(4-nitrophenyl)-1,2,4-triazole
InChI:
InChI=1S/C8H5BrN4O2/c9-8-10-5-12(11-8)6-1-3-7(4-2-6)13(14)15/h1-5H
InChI Key:
CMJIFYZIPZNUOY-UHFFFAOYSA-N
SMILES:
Brc1ncn(n1)c1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
239  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.96g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
269.058g/mol
Monoisotopic Mass:
267.96g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
76.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties