Home Carboxys 6-Trifluoromethoxy-3-indazolecarboxylic acid

6-Trifluoromethoxy-3-indazolecarboxylic acid

CAS No.:
869782-97-8
Catalog Number:
AG004NXI
Molecular Formula:
C9H5F3N2O3
Molecular Weight:
246.1428
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
97%
In Stock USA
United States
$113
- +
250mg
97%
In Stock USA
United States
$200
- +
1g
97%
In Stock USA
United States
$463
- +
5g
97%
In Stock USA
United States
$1875
- +
Product Description
Catalog Number:
AG004NXI
Chemical Name:
6-Trifluoromethoxy-3-indazolecarboxylic acid
CAS Number:
869782-97-8
Molecular Formula:
C9H5F3N2O3
Molecular Weight:
246.1428
MDL Number:
MFCD06739136
IUPAC Name:
6-(trifluoromethoxy)-1H-indazole-3-carboxylic acid
InChI:
InChI=1S/C9H5F3N2O3/c10-9(11,12)17-4-1-2-5-6(3-4)13-14-7(5)8(15)16/h1-3H,(H,13,14)(H,15,16)
InChI Key:
DBSBRTKNVSHDMD-UHFFFAOYSA-N
SMILES:
OC(=O)c1n[nH]c2c1ccc(c2)OC(F)(F)F
Properties
Complexity:
310  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.025g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
246.145g/mol
Monoisotopic Mass:
246.025g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
75.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties