5-octylsulfanylpentanoic acid
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5-octylsulfanylpentanoic acid
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CAS No:
119290-09-4
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Formula:
C13H26O2S
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Chemical Name:
5-octylsulfanylpentanoic acid
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Synonyms:
5-(octylsulfanyl)pentanoic acid;5-octylsulfanylpentanoic acid;119290-09-4;5-n-Octylsulfanylpentanoic acid;5-octylthiopentanoic acid;5-(Octylthio)pentanoic acid;SCHEMBL7201642;ZINC2387442;MFCD01872216;SBB001710;STK676398;AKOS005594303;MCULE-1196712745;NCGC00332340-01;ST4054508;AB01325574-02
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CAS No:
Computed Properties
Molecular Weight:246.41
XLogP3:4.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:12
Exact Mass:246.16535124
Monoisotopic Mass:246.16535124
Topological Polar Surface Area:62.6
Heavy Atom Count:16
Complexity:160
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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