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1261840-25-8 | 4-Pyridinamine, 3-[4-(trifluoromethoxy)phenyl]-
CAS No: 1261840-25-8 Catalog No: AG000S1O MDL No:
Product Description
Catalog Number:
AG000S1O
Chemical Name:
4-Pyridinamine, 3-[4-(trifluoromethoxy)phenyl]-
CAS Number:
1261840-25-8
Molecular Formula:
C12H9F3N2O
Molecular Weight:
254.2079
IUPAC Name:
3-[4-(trifluoromethoxy)phenyl]pyridin-4-amine
InChI:
InChI=1S/C12H9F3N2O/c13-12(14,15)18-9-3-1-8(2-4-9)10-7-17-6-5-11(10)16/h1-7H,(H2,16,17)
InChI Key:
NCFKNZZAUJSJDM-UHFFFAOYSA-N
SMILES:
Nc1ccncc1c1ccc(cc1)OC(F)(F)F
Properties
Complexity:
265
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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