3-ethylsulfanylbutanoic acid
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3-ethylsulfanylbutanoic acid
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CAS No:
89534-40-7
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Formula:
C6H12O2S
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Chemical Name:
3-ethylsulfanylbutanoic acid
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Synonyms:
Butanoic acid,3-(ethylthio); 3-(ethylthio)-butyric acid; 3-(Ethylsulfanyl)butanoic acid; dl-3-Ethylthio-buttersaeure;
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CAS No:
Computed Properties
Molecular Weight:148.23
XLogP3:1.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:148.05580079
Monoisotopic Mass:148.05580079
Topological Polar Surface Area:62.6
Heavy Atom Count:9
Complexity:93.1
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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