3-pentylsulfanylpropanoic acid
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3-pentylsulfanylpropanoic acid
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CAS No:
59358-12-2
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Formula:
C8H16O2S
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Chemical Name:
3-pentylsulfanylpropanoic acid
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Synonyms:
59358-12-2;3-(pentylsulfanyl)propanoic acid;NSC8525;SCHEMBL4554805;DTXSID30278619;NSC-8525;ZINC1586795;AKOS000174112
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CAS No:
Computed Properties
Molecular Weight:176.28
XLogP3:2.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:7
Exact Mass:176.08710092
Monoisotopic Mass:176.08710092
Topological Polar Surface Area:62.6
Heavy Atom Count:11
Complexity:104
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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