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Home > Fluorides > 820224-55-3
820224-55-3 | 3-Pyridinecarboxamide, 6-[(2,5-difluorophenyl)hydroxymethyl]-5-fluoro-
CAS No: 820224-55-3 Catalog No: AG005E1L MDL No:
Product Description
Catalog Number:
AG005E1L
Chemical Name:
3-Pyridinecarboxamide, 6-[(2,5-difluorophenyl)hydroxymethyl]-5-fluoro-
CAS Number:
820224-55-3
Molecular Formula:
C13H9F3N2O2
Molecular Weight:
282.2180
IUPAC Name:
6-[(2,5-difluorophenyl)-hydroxymethyl]-5-fluoropyridine-3-carboxamide
InChI:
InChI=1S/C13H9F3N2O2/c14-7-1-2-9(15)8(4-7)12(19)11-10(16)3-6(5-18-11)13(17)20/h1-5,12,19H,(H2,17,20)
InChI Key:
YGMFBYWBRJFCRS-UHFFFAOYSA-N
SMILES:
Fc1ccc(c(c1)C(c1ncc(cc1F)C(=O)N)O)F
Properties
Complexity:
359
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.062g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
282.222g/mol
Monoisotopic Mass:
282.062g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
76.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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