3,3-bis(ethylsulfanyl)-4-(N-methylanilino)-4,5,6,7,8,9-hexahydrocyclohepta[b]pyran-2-one
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3,3-bis(ethylsulfanyl)-4-(N-methylanilino)-4,5,6,7,8,9-hexahydrocyclohepta[b]pyran-2-one
structure -
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CAS No:
63154-99-4
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Formula:
C21H29NO2S2
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Chemical Name:
3,3-bis(ethylsulfanyl)-4-(N-methylanilino)-4,5,6,7,8,9-hexahydrocyclohepta[b]pyran-2-one
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Synonyms:
63154-99-4;NSC293914;DTXSID00315308;NSC-293914;3,3-bis(ethylsulfanyl)-4-(N-methylanilino)-4,5,6,7,8,9-hexahydrocyclohepta[b]pyran-2-one
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CAS No:
3,3-bis(ethylsulfanyl)-4-(N-methylanilino)-4,5,6,7,8,9-hexahydrocyclohepta[b]pyran-2-one Basic Attributes
391.6 g/mol
391.16397151 g/mol
293914
DTXSID00315308
Computed Properties
Molecular Weight:391.6
XLogP3:5.3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:391.16397151
Monoisotopic Mass:391.16397151
Topological Polar Surface Area:80.1
Heavy Atom Count:26
Complexity:522
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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