methyl 2-acetamido-2-acetylsulfanyl-3-chloropropanoate
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methyl 2-acetamido-2-acetylsulfanyl-3-chloropropanoate
structure -
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CAS No:
58178-01-1
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Formula:
C8H12ClNO4S
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Chemical Name:
methyl 2-acetamido-2-acetylsulfanyl-3-chloropropanoate
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Synonyms:
58178-01-1;NSC262144;DTXSID60312777;NSC-262144;DS-000959;Methyl N-acetyl-2-(acetylsulfanyl)-3-chloroalaninate;methyl 2-acetamido-2-acetylsulfanyl-3-chloro-propanoate
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CAS No:
methyl 2-acetamido-2-acetylsulfanyl-3-chloropropanoate Basic Attributes
253.70 g/mol
253.0175567 g/mol
262144
DTXSID60312777
Computed Properties
Molecular Weight:253.70
XLogP3:0.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:253.0175567
Monoisotopic Mass:253.0175567
Topological Polar Surface Area:97.8
Heavy Atom Count:15
Complexity:284
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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