Home Carboxys Ethyl 1-methyl-5-(trifluoromethyl)-1h-pyrazole-4-carboxylate

Ethyl 1-methyl-5-(trifluoromethyl)-1h-pyrazole-4-carboxylate

CAS No.:
231285-86-2
Catalog Number:
AG002MA2
Molecular Formula:
C8H9F3N2O2
Molecular Weight:
222.1645
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
97%
1 week
United States
$31
- +
250mg
97%
1 week
United States
$59
- +
1g
≥ 98% (HPLC)
1 week
United States
$190
- +
5g
≥ 98% (HPLC)
1 week
United States
$719
- +
Product Description
Catalog Number:
AG002MA2
Chemical Name:
Ethyl 1-methyl-5-(trifluoromethyl)-1h-pyrazole-4-carboxylate
CAS Number:
231285-86-2
Molecular Formula:
C8H9F3N2O2
Molecular Weight:
222.1645
MDL Number:
MFCD00277430
IUPAC Name:
ethyl 1-methyl-5-(trifluoromethyl)pyrazole-4-carboxylate
InChI:
InChI=1S/C8H9F3N2O2/c1-3-15-7(14)5-4-12-13(2)6(5)8(9,10)11/h4H,3H2,1-2H3
InChI Key:
RQDQIVPSSDGXQU-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cnn(c1C(F)(F)F)C
Properties
Complexity:
245  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.062g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
222.167g/mol
Monoisotopic Mass:
222.062g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties