9,10-dithiocyanatooctadecanoic acid
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9,10-dithiocyanatooctadecanoic acid
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CAS No:
42877-26-9
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Formula:
C20H34N2O2S2
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Chemical Name:
9,10-dithiocyanatooctadecanoic acid
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Synonyms:
9,10-dithiocyanatooctadecanoic acid;42877-26-9;NSC189690;DTXSID30307135;NSC-189690
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CAS No:
9,10-dithiocyanatooctadecanoic acid Basic Attributes
398.6 g/mol
398.20617068 g/mol
189690
DTXSID30307135
Computed Properties
Molecular Weight:398.6
XLogP3:7.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:18
Exact Mass:398.20617068
Monoisotopic Mass:398.20617068
Topological Polar Surface Area:136
Heavy Atom Count:26
Complexity:453
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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