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Home > Pyridines > 1286714-43-9
1286714-43-9 | 6-(naphthalen-2-yl)pyridazine-3-thiol
CAS No: 1286714-43-9 Catalog No: AG018BLG MDL No:
Product Description
Catalog Number:
AG018BLG
Chemical Name:
6-(naphthalen-2-yl)pyridazine-3-thiol
CAS Number:
1286714-43-9
Molecular Formula:
C14H10N2S
Molecular Weight:
238.3076
IUPAC Name:
3-naphthalen-2-yl-1H-pyridazine-6-thione
InChI:
InChI=1S/C14H10N2S/c17-14-8-7-13(15-16-14)12-6-5-10-3-1-2-4-11(10)9-12/h1-9H,(H,16,17)
InChI Key:
DXYMSEYOCVHYCR-UHFFFAOYSA-N
SMILES:
Sc1ccc(nn1)c1ccc2c(c1)cccc2
Properties
Complexity:
372
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.056g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
238.308g/mol
Monoisotopic Mass:
238.056g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
56.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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