Home Other Building Blocks 5-tert-Butyl-3-(trifluoromethyl)-1h-pyrazole

5-tert-Butyl-3-(trifluoromethyl)-1h-pyrazole

CAS No.:
150433-22-0
Catalog Number:
AG001MM7
Molecular Formula:
C8H11F3N2
Molecular Weight:
192.1815
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$75
- +
1g
95%
In Stock USA
United States
$156
- +
5g
95%
In Stock USA
United States
$432
- +
Product Description
Catalog Number:
AG001MM7
Chemical Name:
5-tert-Butyl-3-(trifluoromethyl)-1h-pyrazole
CAS Number:
150433-22-0
Molecular Formula:
C8H11F3N2
Molecular Weight:
192.1815
MDL Number:
MFCD00729044
IUPAC Name:
3-tert-butyl-5-(trifluoromethyl)-1H-pyrazole
InChI:
InChI=1S/C8H11F3N2/c1-7(2,3)5-4-6(13-12-5)8(9,10)11/h4H,1-3H3,(H,12,13)
InChI Key:
YIEPWAOKLZRBEL-UHFFFAOYSA-N
SMILES:
CC(c1n[nH]c(c1)C(F)(F)F)(C)C
Properties
Complexity:
183  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.087g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
192.185g/mol
Monoisotopic Mass:
192.087g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties