Home Halogens 1-Benzyl-5-bromo-6-fluorobenzotriazole

1-Benzyl-5-bromo-6-fluorobenzotriazole

CAS No.:
1365272-70-3
Catalog Number:
AG001213
Molecular Formula:
C13H9BrFN3
Molecular Weight:
306.1331
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$75
- +
5g
98%
In Stock USA
United States
$225
- +
10g
98%
In Stock USA
United States
$350
- +
25g
98%
In Stock USA
United States
$600
- +
Product Description
Catalog Number:
AG001213
Chemical Name:
1-Benzyl-5-bromo-6-fluorobenzotriazole
CAS Number:
1365272-70-3
Molecular Formula:
C13H9BrFN3
Molecular Weight:
306.1331
MDL Number:
MFCD17014273
IUPAC Name:
1-benzyl-5-bromo-6-fluorobenzotriazole
InChI:
InChI=1S/C13H9BrFN3/c14-10-6-12-13(7-11(10)15)18(17-16-12)8-9-4-2-1-3-5-9/h1-7H,8H2
InChI Key:
JTZWFCMDDNXPTP-UHFFFAOYSA-N
SMILES:
Brc1cc2nnn(c2cc1F)Cc1ccccc1
Properties
Complexity:
285  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
304.996g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
306.138g/mol
Monoisotopic Mass:
304.996g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
30.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Properties