Home Carboxys tert-Butyl 5-(trifluoromethoxy)-1h-indazole-1-carboxylate

tert-Butyl 5-(trifluoromethoxy)-1h-indazole-1-carboxylate

CAS No.:
1346521-27-4
Catalog Number:
AG00A066
Molecular Formula:
C13H13F3N2O3
Molecular Weight:
302.2491
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$357
- +
Product Description
Catalog Number:
AG00A066
Chemical Name:
tert-Butyl 5-(trifluoromethoxy)-1h-indazole-1-carboxylate
CAS Number:
1346521-27-4
Molecular Formula:
C13H13F3N2O3
Molecular Weight:
302.2491
MDL Number:
MFCD20481820
IUPAC Name:
tert-butyl 5-(trifluoromethoxy)indazole-1-carboxylate
InChI:
InChI=1S/C13H13F3N2O3/c1-12(2,3)21-11(19)18-10-5-4-9(20-13(14,15)16)6-8(10)7-17-18/h4-7H,1-3H3
InChI Key:
BWWMSZUCQJXCLB-UHFFFAOYSA-N
SMILES:
O=C(n1ncc2c1ccc(c2)OC(F)(F)F)OC(C)(C)C
Properties
Complexity:
395  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
302.088g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
302.253g/mol
Monoisotopic Mass:
302.088g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
53.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4  
Properties