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Home Carboxys 5-(Trifluoromethyl)-1h-benzo[d]imidazole-2-carboxylic acid

5-(Trifluoromethyl)-1h-benzo[d]imidazole-2-carboxylic acid

CAS No.:
2107-39-3
Catalog Number:
AG002KXR
Molecular Formula:
C9H5F3N2O2
Molecular Weight:
230.1434
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
97%
In Stock USA
United States
$94
- +
250mg
97%
In Stock USA
United States
$163
- +
1g
97%
In Stock USA
United States
$325
- +
5g
97%
In Stock USA
United States
$1225
- +
Product Description
Catalog Number:
AG002KXR
Chemical Name:
5-(Trifluoromethyl)-1h-benzo[d]imidazole-2-carboxylic acid
CAS Number:
2107-39-3
Molecular Formula:
C9H5F3N2O2
Molecular Weight:
230.1434
MDL Number:
MFCD11052827
IUPAC Name:
6-(trifluoromethyl)-1H-benzimidazole-2-carboxylic acid
InChI:
InChI=1S/C9H5F3N2O2/c10-9(11,12)4-1-2-5-6(3-4)14-7(13-5)8(15)16/h1-3H,(H,13,14)(H,15,16)
InChI Key:
CNQZCURJVWLZKT-UHFFFAOYSA-N
SMILES:
OC(=O)c1nc2c([nH]1)cc(cc2)C(F)(F)F
Properties
Complexity:
295  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.03g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
230.146g/mol
Monoisotopic Mass:
230.03g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties