3-(Octylthio)propanoic acid
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3-(Octylthio)propanoic acid
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CAS No:
6964-23-4
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Formula:
C11H22O2S
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Chemical Name:
3-(Octylthio)propanoic acid
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Synonyms:
Propanoic acid,3-(octylthio)-;Propionic acid,3-(octylthio)-;3-(Octylthio)propanoic acid;3-(Octylthio)propionic acid;NSC 66313;3-Octylsulfanyl-propionic acid
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CAS No:
Computed Properties
Molecular Weight:218.36
XLogP3:3.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:10
Exact Mass:218.13405111
Monoisotopic Mass:218.13405111
Topological Polar Surface Area:62.6
Heavy Atom Count:14
Complexity:137
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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