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1258626-19-5 | 3-Pyridinamine, 5-[3-(trifluoromethoxy)phenyl]-
CAS No: 1258626-19-5 Catalog No: AG000OUY MDL No:
Product Description
Catalog Number:
AG000OUY
Chemical Name:
3-Pyridinamine, 5-[3-(trifluoromethoxy)phenyl]-
CAS Number:
1258626-19-5
Molecular Formula:
C12H9F3N2O
Molecular Weight:
254.2079
IUPAC Name:
5-[3-(trifluoromethoxy)phenyl]pyridin-3-amine
InChI:
InChI=1S/C12H9F3N2O/c13-12(14,15)18-11-3-1-2-8(5-11)9-4-10(16)7-17-6-9/h1-7H,16H2
InChI Key:
OXNIYHVYNRQAGJ-UHFFFAOYSA-N
SMILES:
Nc1cncc(c1)c1cccc(c1)OC(F)(F)F
Properties
Complexity:
273
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.067g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
254.212g/mol
Monoisotopic Mass:
254.067g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
48.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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