Home Halogens 1-Boc-3-bromo-5-nitro-1h-indazole

1-Boc-3-bromo-5-nitro-1h-indazole

CAS No.:
473416-22-7
Catalog Number:
AG003E16
Molecular Formula:
C12H12BrN3O4
Molecular Weight:
342.1454
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$119
- +
5g
97%
In Stock USA
United States
$369
- +
10g
97%
In Stock USA
United States
$619
- +
25g
97%
In Stock USA
United States
$1057
- +
Product Description
Catalog Number:
AG003E16
Chemical Name:
1-Boc-3-bromo-5-nitro-1h-indazole
CAS Number:
473416-22-7
Molecular Formula:
C12H12BrN3O4
Molecular Weight:
342.1454
MDL Number:
MFCD11617131
IUPAC Name:
tert-butyl 3-bromo-5-nitroindazole-1-carboxylate
InChI:
InChI=1S/C12H12BrN3O4/c1-12(2,3)20-11(17)15-9-5-4-7(16(18)19)6-8(9)10(13)14-15/h4-6H,1-3H3
InChI Key:
BWYOEKHPBGLTHI-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc2c(c1)c(Br)nn2C(=O)OC(C)(C)C
Properties
Complexity:
407  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
341.001g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
342.149g/mol
Monoisotopic Mass:
341.001g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
89.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Properties