Home Other Building Blocks 6-Fluoro-3H-1,2,3-benzotriazin-4-one

6-Fluoro-3H-1,2,3-benzotriazin-4-one

CAS No.:
1008742-31-1
Catalog Number:
AG00H9D6
Molecular Formula:
C7H4FN3O
Molecular Weight:
165.1246
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$313
- +
5g
97%
In Stock USA
United States
$1100
- +
Product Description
Catalog Number:
AG00H9D6
Chemical Name:
6-Fluoro-3H-1,2,3-benzotriazin-4-one
CAS Number:
1008742-31-1
Molecular Formula:
C7H4FN3O
Molecular Weight:
165.1246
MDL Number:
MFCD29993140
IUPAC Name:
6-fluoro-3H-1,2,3-benzotriazin-4-one
InChI:
InChI=1S/C7H4FN3O/c8-4-1-2-6-5(3-4)7(12)10-11-9-6/h1-3H,(H,9,10,12)
InChI Key:
RCLQFKLASUKMCG-UHFFFAOYSA-N
SMILES:
Fc1ccc2c(c1)c(=O)[nH]nn2
Properties
Complexity:
231  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.034g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
165.127g/mol
Monoisotopic Mass:
165.034g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
53.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties