1-butylsulfanyl-2,3,6-trimethylhept-6-en-4-yn-3-ol
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1-butylsulfanyl-2,3,6-trimethylhept-6-en-4-yn-3-ol
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CAS No:
77922-39-5
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Formula:
C14H24OS
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Chemical Name:
1-butylsulfanyl-2,3,6-trimethylhept-6-en-4-yn-3-ol
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Synonyms:
77922-39-5;BRN 4392057;2,5,6-Trimethyl-7-butylthiohept-1-en-3-yn-5-ol;1-(Butylthio)-2,3,6-trimethyl-6-hepten-4-yn-3-ol;6-HEPTEN-4-YN-3-OL, 1-(BUTYLTHIO)-2,3,6-TRIMETHYL-;DTXSID20999124;1-(butylsulfanyl)-2,3,6-trimethylhept-6-en-4-yn-3-ol
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CAS No:
Computed Properties
Molecular Weight:240.41
XLogP3:4.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:8
Exact Mass:240.15478656
Monoisotopic Mass:240.15478656
Topological Polar Surface Area:45.5
Heavy Atom Count:16
Complexity:284
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 1-butylsulfanyl-2,3,6-trimethylhept-6-en-4-yn-3-ol
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