Home Aldehydes 1-(Oxan-2-yl)-3-(trifluoromethyl)pyrazole-5-carboxaldehyde

1-(Oxan-2-yl)-3-(trifluoromethyl)pyrazole-5-carboxaldehyde

CAS No.:
1437794-28-9
Catalog Number:
AG001ICF
Molecular Formula:
C10H11F3N2O2
Molecular Weight:
248.2017
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$250
- +
5g
97%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG001ICF
Chemical Name:
1-(Oxan-2-yl)-3-(trifluoromethyl)pyrazole-5-carboxaldehyde
CAS Number:
1437794-28-9
Molecular Formula:
C10H11F3N2O2
Molecular Weight:
248.2017
MDL Number:
MFCD24448787
IUPAC Name:
2-(oxan-2-yl)-5-(trifluoromethyl)pyrazole-3-carbaldehyde
InChI:
InChI=1S/C10H11F3N2O2/c11-10(12,13)8-5-7(6-16)15(14-8)9-3-1-2-4-17-9/h5-6,9H,1-4H2
InChI Key:
PZQZOLLJNBPAHA-UHFFFAOYSA-N
SMILES:
O=Cc1cc(nn1C1CCCCO1)C(F)(F)F
Properties
Complexity:
285  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.077g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
248.205g/mol
Monoisotopic Mass:
248.077g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties