methyl (2Z)-2-(2-oxothiomorpholin-3-ylidene)acetate
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methyl (2Z)-2-(2-oxothiomorpholin-3-ylidene)acetate
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CAS No:
1164465-63-7
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Formula:
C7H9NO3S
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Chemical Name:
methyl (2Z)-2-(2-oxothiomorpholin-3-ylidene)acetate
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Synonyms:
methyl (2Z)-(2-oxothiomorpholin-3-ylidene)ethanoate;SMR000048429;MLS000083537;CHEMBL3207451;HMS2393C06;STK202809;AKOS002216135;ZINC100118192;ST50132576;(Z)-methyl 2-(2-oxothiomorpholin-3-ylidene)acetate;methyl (2Z)-(2-oxothiomorpholin-3-ylidene)acetate;methyl 2-(2-oxo-1,4-thiazaperhydroin-3-ylidene)acetate;1164465-63-7
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CAS No:
methyl (2Z)-2-(2-oxothiomorpholin-3-ylidene)acetate Basic Attributes
187.22 g/mol
187.03031432 g/mol
Computed Properties
Molecular Weight:187.22
XLogP3:0.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:187.03031432
Monoisotopic Mass:187.03031432
Topological Polar Surface Area:80.7
Heavy Atom Count:12
Complexity:237
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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