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Home > Fluorides > 137506-69-5
137506-69-5 | Pyridine, 2-(2,2,2-trifluoroethoxy)-4-(trifluoromethyl)-
CAS No: 137506-69-5 Catalog No: AG0013E5 MDL No:
Product Description
Catalog Number:
AG0013E5
Chemical Name:
Pyridine, 2-(2,2,2-trifluoroethoxy)-4-(trifluoromethyl)-
CAS Number:
137506-69-5
Molecular Formula:
C8H5F6NO
Molecular Weight:
245.1218
IUPAC Name:
2-(2,2,2-trifluoroethoxy)-4-(trifluoromethyl)pyridine
InChI:
InChI=1S/C8H5F6NO/c9-7(10,11)4-16-6-3-5(1-2-15-6)8(12,13)14/h1-3H,4H2
InChI Key:
WQYJZQZDMGBIFV-UHFFFAOYSA-N
SMILES:
FC(COc1nccc(c1)C(F)(F)F)(F)F
Properties
Complexity:
226
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.028g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
245.124g/mol
Monoisotopic Mass:
245.028g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
22.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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