1-ethylsulfanyl-2,3,6-trimethylhept-6-en-4-yn-3-ol
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1-ethylsulfanyl-2,3,6-trimethylhept-6-en-4-yn-3-ol
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CAS No:
77922-37-3
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Formula:
C12H20OS
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Chemical Name:
1-ethylsulfanyl-2,3,6-trimethylhept-6-en-4-yn-3-ol
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Synonyms:
77922-37-3;BRN 4383208;2,5,6-Trimethyl-7-ethylthiohept-1-en-3-yn-5-ol;1-(Ethylthio)-2,3,6-trimethyl-6-hepten-4-yn-3-ol;6-HEPTEN-4-YN-3-OL, 1-(ETHYLTHIO)-2,3,6-TRIMETHYL-;DTXSID00999122;1-(ETHYLSULFANYL)-2,3,6-TRIMETHYLHEPT-6-EN-4-YN-3-OL
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CAS No:
Computed Properties
Molecular Weight:212.35
XLogP3:3.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:6
Exact Mass:212.12348643
Monoisotopic Mass:212.12348643
Topological Polar Surface Area:45.5
Heavy Atom Count:14
Complexity:258
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 1-ethylsulfanyl-2,3,6-trimethylhept-6-en-4-yn-3-ol
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