methyl 2-acetamido-4-ethenylsulfanylbutanoate
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methyl 2-acetamido-4-ethenylsulfanylbutanoate
structure -
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CAS No:
70858-13-8
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Formula:
C9H15NO3S
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Chemical Name:
methyl 2-acetamido-4-ethenylsulfanylbutanoate
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Synonyms:
70858-13-8;N-Acetyl-vinthionine methyl ester;BUTYRIC ACID, 2-ACETAMIDO-4-(VINYLTHIO)-, METHYL ESTER;DTXSID30991134;2-Acetylamino-4-(vinylthio)butyric acid methyl ester;N-[4-(Ethenylsulfanyl)-1-methoxy-1-oxobutan-2-yl]ethanimidic acid
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CAS No:
Computed Properties
Molecular Weight:217.29
XLogP3:0.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:7
Exact Mass:217.07726451
Monoisotopic Mass:217.07726451
Topological Polar Surface Area:80.7
Heavy Atom Count:14
Complexity:218
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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