4-acetyl-5-cyano-3-sulfanylidenemorpholine-2-carboxylic acid
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4-acetyl-5-cyano-3-sulfanylidenemorpholine-2-carboxylic acid
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CAS No:
74514-76-4
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Formula:
C8H8N2O4S
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Chemical Name:
4-acetyl-5-cyano-3-sulfanylidenemorpholine-2-carboxylic acid
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Synonyms:
N-acetyl-3-carboxy-5-cyanotetrahydro-1,4-2H-thiazine;NACCTT;74514-76-4;4-acetyl-5-cyano-3-sulfanylidenemorpholine-2-carboxylic acid;4-Acetyl-5-cyano-3-thioxo-2-morpholinecarboxylic acid;Nacctt;DTXSID30996028;3-Thiomorpholinecarboxylic acid, 4-acetyl-5-cyano-;N-Acetyl-3-carboxy-5-cyanotetrahydro-1,4-2H-thiazine
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CAS No:
4-acetyl-5-cyano-3-sulfanylidenemorpholine-2-carboxylic acid Basic Attributes
228.23 g/mol
228.02047791 g/mol
Computed Properties
Molecular Weight:228.23
XLogP3:-0.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:1
Exact Mass:228.02047791
Monoisotopic Mass:228.02047791
Topological Polar Surface Area:123
Heavy Atom Count:15
Complexity:372
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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