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1314988-51-6 | 2-Pyridinamine, 5-(4-fluoro-3-methoxyphenyl)-
CAS No: 1314988-51-6 Catalog No: AG000WCJ MDL No:MFCD19684180
Product Description
Catalog Number:
AG000WCJ
Chemical Name:
2-Pyridinamine, 5-(4-fluoro-3-methoxyphenyl)-
CAS Number:
1314988-51-6
Molecular Formula:
C12H11FN2O
Molecular Weight:
218.2269
MDL Number:
MFCD19684180
IUPAC Name:
5-(4-fluoro-3-methoxyphenyl)pyridin-2-amine
InChI:
InChI=1S/C12H11FN2O/c1-16-11-6-8(2-4-10(11)13)9-3-5-12(14)15-7-9/h2-7H,1H3,(H2,14,15)
InChI Key:
LBMANGMZSHEEFD-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1F)c1ccc(nc1)N
Properties
Complexity:
227
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.086g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
218.231g/mol
Monoisotopic Mass:
218.086g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
48.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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