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1443336-37-5 | 2-[3-(Trifluoromethoxy)benzoyl]pyridine
CAS No: 1443336-37-5 Catalog No: AG01FCED MDL No:
Product Description
Catalog Number:
AG01FCED
Chemical Name:
2-[3-(Trifluoromethoxy)benzoyl]pyridine
CAS Number:
1443336-37-5
Molecular Formula:
C13H8F3NO2
Molecular Weight:
267.2033
IUPAC Name:
pyridin-2-yl-[3-(trifluoromethoxy)phenyl]methanone
InChI:
InChI=1S/C13H8F3NO2/c14-13(15,16)19-10-5-3-4-9(8-10)12(18)11-6-1-2-7-17-11/h1-8H
InChI Key:
RKQXPUCSNNCMEN-UHFFFAOYSA-N
SMILES:
O=C(c1cccc(c1)OC(F)(F)F)c1ccccn1
Properties
Complexity:
320
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.051g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
267.207g/mol
Monoisotopic Mass:
267.051g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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