Home Carboxys 5-Methyl-2-(3-trifluoromethyl-phenyl)-2h-pyrazole-3-carboxylic acid

5-Methyl-2-(3-trifluoromethyl-phenyl)-2h-pyrazole-3-carboxylic acid

CAS No.:
126067-58-1
Catalog Number:
AG000R1C
Molecular Formula:
C12H9F3N2O2
Molecular Weight:
270.2073
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
97%
1 week
United States
$331
- +
500mg
97%
1 week
United States
$778
- +
Product Description
Catalog Number:
AG000R1C
Chemical Name:
5-Methyl-2-(3-trifluoromethyl-phenyl)-2h-pyrazole-3-carboxylic acid
CAS Number:
126067-58-1
Molecular Formula:
C12H9F3N2O2
Molecular Weight:
270.2073
MDL Number:
MFCD17926481
IUPAC Name:
5-methyl-2-[3-(trifluoromethyl)phenyl]pyrazole-3-carboxylic acid
InChI:
InChI=1S/C12H9F3N2O2/c1-7-5-10(11(18)19)17(16-7)9-4-2-3-8(6-9)12(13,14)15/h2-6H,1H3,(H,18,19)
InChI Key:
HZTAGHDDVYOKGC-UHFFFAOYSA-N
SMILES:
Cc1nn(c(c1)C(=O)O)c1cccc(c1)C(F)(F)F
Properties
Complexity:
348  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.062g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
270.211g/mol
Monoisotopic Mass:
270.062g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties