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

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

CAS No.:
459133-68-7
Catalog Number:
AG00DJL5
Molecular Formula:
C12H12BrIN2O2
Molecular Weight:
423.0443
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
In Stock USA
United States
$119
- +
1g
98%
In Stock USA
United States
$288
- +
5g
98%
In Stock USA
United States
$1125
- +
Product Description
Catalog Number:
AG00DJL5
Chemical Name:
1-Boc-5-bromo-3-iodo-1h-indazole
CAS Number:
459133-68-7
Molecular Formula:
C12H12BrIN2O2
Molecular Weight:
423.0443
MDL Number:
MFCD09056828
IUPAC Name:
tert-butyl 5-bromo-3-iodoindazole-1-carboxylate
InChI:
InChI=1S/C12H12BrIN2O2/c1-12(2,3)18-11(17)16-9-5-4-7(13)6-8(9)10(14)15-16/h4-6H,1-3H3
InChI Key:
RUXGCTDRNQBDSV-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1)c(I)nn2C(=O)OC(C)(C)C
Properties
Complexity:
335  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
421.913g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
423.048g/mol
Monoisotopic Mass:
421.913g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2  
Properties