Home Nitriles 8-(Trifluoromethyl)quinoline-4-carbonitrile

8-(Trifluoromethyl)quinoline-4-carbonitrile

CAS No.:
2055119-28-1
Catalog Number:
AG00I3X3
Molecular Formula:
C11H5F3N2
Molecular Weight:
222.1660
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
In Stock USA
United States
$250
- +
1g
97%
In Stock USA
United States
$525
- +
Product Description
Catalog Number:
AG00I3X3
Chemical Name:
8-(Trifluoromethyl)quinoline-4-carbonitrile
CAS Number:
2055119-28-1
Molecular Formula:
C11H5F3N2
Molecular Weight:
222.1660
MDL Number:
MFCD30527651
IUPAC Name:
8-(trifluoromethyl)quinoline-4-carbonitrile
InChI:
InChI=1S/C11H5F3N2/c12-11(13,14)9-3-1-2-8-7(6-15)4-5-16-10(8)9/h1-5H
InChI Key:
GGLAMLCHJQORHZ-UHFFFAOYSA-N
SMILES:
N#Cc1ccnc2c1cccc2C(F)(F)F
Properties
Complexity:
304  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.04g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
222.17g/mol
Monoisotopic Mass:
222.04g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
36.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties