4-ethylsulfanylbutanoic acid
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4-ethylsulfanylbutanoic acid
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CAS No:
71057-15-3
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Formula:
C6H12O2S
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Chemical Name:
4-ethylsulfanylbutanoic acid
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Synonyms:
NSC84216;71057-15-3;Butyric acid, 4-ethylthio-;4-(ethylthio)butanoic acid;4-(ethylsulfanyl)butanoic acid;NSC-84216;4-ethylsulfanylbutanoic acid;4-(Ethylthio)butric acid;NCIStruc1_001872;NCIStruc2_000219;SCHEMBL6243134;CHEMBL1414037;DTXSID60221274;NCI84216;ZINC1736707;CCG-37669;NCGC00013880;NSC 84216;AKOS000220303;NCGC00013880-02;NCGC00096990-01;NCI60_041852
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CAS No:
Computed Properties
Molecular Weight:148.23
XLogP3:1.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:148.05580079
Monoisotopic Mass:148.05580079
Topological Polar Surface Area:62.6
Heavy Atom Count:9
Complexity:83.1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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