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1261814-93-0 | 4-Pyridinamine, 3-[2-(trifluoromethyl)phenyl]-
CAS No: 1261814-93-0 Catalog No: AG000S13 MDL No:MFCD18418409
Product Description
Catalog Number:
AG000S13
Chemical Name:
4-Pyridinamine, 3-[2-(trifluoromethyl)phenyl]-
CAS Number:
1261814-93-0
Molecular Formula:
C12H9F3N2
Molecular Weight:
238.2085
MDL Number:
MFCD18418409
IUPAC Name:
3-[2-(trifluoromethyl)phenyl]pyridin-4-amine
InChI:
InChI=1S/C12H9F3N2/c13-12(14,15)10-4-2-1-3-8(10)9-7-17-6-5-11(9)16/h1-7H,(H2,16,17)
InChI Key:
PDBQPEVFUARRGH-UHFFFAOYSA-N
SMILES:
Nc1ccncc1c1ccccc1C(F)(F)F
Properties
Complexity:
255
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.072g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
238.213g/mol
Monoisotopic Mass:
238.072g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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