Home Nitriles 5-Bromo-1h-indazole-3-carbonitrile

5-Bromo-1h-indazole-3-carbonitrile

CAS No.:
201227-39-6
Catalog Number:
AG002DA7
Molecular Formula:
C8H4BrN3
Molecular Weight:
222.0415
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$100
- +
5g
98%
In Stock USA
United States
$400
- +
10g
98%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG002DA7
Chemical Name:
5-Bromo-1h-indazole-3-carbonitrile
CAS Number:
201227-39-6
Molecular Formula:
C8H4BrN3
Molecular Weight:
222.0415
MDL Number:
MFCD07371567
IUPAC Name:
5-bromo-1H-indazole-3-carbonitrile
InChI:
InChI=1S/C8H4BrN3/c9-5-1-2-7-6(3-5)8(4-10)12-11-7/h1-3H,(H,11,12)
InChI Key:
QIULWQLXNFSZJG-UHFFFAOYSA-N
SMILES:
Brc1cc2c(n[nH]c2cc1)C#N
Properties
Complexity:
222  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.959g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
222.045g/mol
Monoisotopic Mass:
220.959g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
52.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties