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Home > Pyridines > 188394-36-7
188394-36-7 | 2-Pyridinemethanol, 6,6'-(3,6-pyridazinediyl)bis-
CAS No: 188394-36-7 Catalog No: AG002GUV MDL No:
Product Description
Catalog Number:
AG002GUV
Chemical Name:
2-Pyridinemethanol, 6,6'-(3,6-pyridazinediyl)bis-
CAS Number:
188394-36-7
Molecular Formula:
C16H14N4O2
Molecular Weight:
294.3080
IUPAC Name:
[6-[6-[6-(hydroxymethyl)pyridin-2-yl]pyridazin-3-yl]pyridin-2-yl]methanol
InChI:
InChI=1S/C16H14N4O2/c21-9-11-3-1-5-13(17-11)15-7-8-16(20-19-15)14-6-2-4-12(10-22)18-14/h1-8,21-22H,9-10H2
InChI Key:
CNMBICRVIRUMPH-UHFFFAOYSA-N
SMILES:
OCc1cccc(n1)c1ccc(nn1)c1cccc(n1)CO
Properties
Complexity:
312
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
294.112g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
294.314g/mol
Monoisotopic Mass:
294.112g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
92A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6
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