ethyl 3-oxo-4-(1,1,3-trioxo-1,2-benzothiazol-2-yl)butanoate
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ethyl 3-oxo-4-(1,1,3-trioxo-1,2-benzothiazol-2-yl)butanoate
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CAS No:
730951-32-3
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Formula:
C13H13NO6S
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Chemical Name:
ethyl 3-oxo-4-(1,1,3-trioxo-1,2-benzothiazol-2-yl)butanoate
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Synonyms:
Ethyl 3-oxo-4-(1,1,3-trioxo-2,3-dihydro-1,2-benzothiazol-2-yl)butanoate;730951-32-3;ethyl 3-oxo-4-(1,1,3-trioxo-1,2-benzothiazol-2-yl)butanoate;ZINC3278520;AKOS000118682;MCULE-5130867983;EN300-06276;SR-01000046996;SR-01000046996-1;Z54791861;ethyl 3-oxo-4-(1,1,3-trioxo-2,3-dihydro-1lambda6,2-benzothiazol-2-yl)butanoate
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CAS No:
ethyl 3-oxo-4-(1,1,3-trioxo-1,2-benzothiazol-2-yl)butanoate Basic Attributes
311.31 g/mol
311.04635831 g/mol
Computed Properties
Molecular Weight:311.31
XLogP3:0.7
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:311.04635831
Monoisotopic Mass:311.04635831
Topological Polar Surface Area:106
Heavy Atom Count:21
Complexity:550
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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