[4-(1-oxo-3-sulfanylidene-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyridin-2-yl)phenyl] thiocyanate
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[4-(1-oxo-3-sulfanylidene-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyridin-2-yl)phenyl] thiocyanate
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CAS No:
76995-62-5
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Formula:
C14H13N3OS2
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Chemical Name:
[4-(1-oxo-3-sulfanylidene-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyridin-2-yl)phenyl] thiocyanate
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Synonyms:
76995-62-5;DTXSID30998284;Thiocyanic acid, 4-(hexahydro-1-oxo-3-thioxoimidazo(1,5-a)pyridin-2(3H)-yl)phenyl ester;2-(4-Thiocyanatophenyl)-3-thioxohexahydroimidazo[1,5-a]pyridin-1(5H)-one;4-(1-Oxo-3-sulfanylidenehexahydroimidazo[1,5-a]pyridin-2(3H)-yl)phenyl thiocyanate
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CAS No:
[4-(1-oxo-3-sulfanylidene-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyridin-2-yl)phenyl] thiocyanate Basic Attributes
303.4 g/mol
303.05000439 g/mol
Computed Properties
Molecular Weight:303.4
XLogP3:2.9
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:303.05000439
Monoisotopic Mass:303.05000439
Topological Polar Surface Area:105
Heavy Atom Count:20
Complexity:464
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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