ETHYL2-OXOTHIANE-3-CARBOXYLATE
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ETHYL2-OXOTHIANE-3-CARBOXYLATE
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CAS No:
4547-45-9
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Formula:
C8H12O3S
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Chemical Name:
ETHYL2-OXOTHIANE-3-CARBOXYLATE
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Synonyms:
ethyl 2-oxothiane-3-carboxylate;Ethyl 2-oxotetrahydro-2H-thiopyran-3-carboxylate;SCHEMBL2642228;CTK4I8827;DTXSID60381160;6267AB;AKOS015897627;ethyl 2-oxidanylidenethiane-3-carboxylate;2-oxo-3-thianecarboxylic acid ethyl ester;DB-070657
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CAS No:
Computed Properties
Molecular Weight:188.25
XLogP3:1.6
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:188.05071541
Monoisotopic Mass:188.05071541
Topological Polar Surface Area:68.7
Heavy Atom Count:12
Complexity:191
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes