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Home > Pyridines > 286943-20-2
286943-20-2 | 3-Pyridinol, 5-(1S,4S)-2,5-diazabicyclo[2.2.1]hept-2-yl-
CAS No: 286943-20-2 Catalog No: AG002W4S MDL No:
Product Description
Catalog Number:
AG002W4S
Chemical Name:
3-Pyridinol, 5-(1S,4S)-2,5-diazabicyclo[2.2.1]hept-2-yl-
CAS Number:
286943-20-2
Molecular Formula:
C10H13N3O
Molecular Weight:
191.2297
IUPAC Name:
5-[(1R,4R)-2,5-diazabicyclo[2.2.1]heptan-2-yl]pyridin-3-ol
InChI:
InChI=1S/C10H13N3O/c14-10-2-9(3-11-5-10)13-6-7-1-8(13)4-12-7/h2-3,5,7-8,12,14H,1,4,6H2/t7-,8-/m1/s1
InChI Key:
FQXZEMJVGYXBEY-HTQZYQBOSA-N
SMILES:
Oc1cncc(c1)N1C[C@@H]2C[C@H]1CN2
Properties
Complexity:
223
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
191.106g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
191.234g/mol
Monoisotopic Mass:
191.106g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
48.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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