2,3,6-trimethyl-1-(3-methylbutylsulfanyl)hept-6-en-4-yn-3-ol
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2,3,6-trimethyl-1-(3-methylbutylsulfanyl)hept-6-en-4-yn-3-ol
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CAS No:
102244-18-8
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Formula:
C15H26OS
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Chemical Name:
2,3,6-trimethyl-1-(3-methylbutylsulfanyl)hept-6-en-4-yn-3-ol
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Synonyms:
102244-18-8;BRN 5511702;2,5,6-Trimethyl-7-isopentylthiohept-1-en-3-yn-5-ol;1-((3-Methylbutyl)thio)-2,3,6-trimethyl-6-hepten-4-yn-3-ol;6-HEPTEN-4-YN-3-OL, 1-((3-METHYLBUTYL)THIO)-2,3,6-TRIMETHYL-;DTXSID80907285;2,3,6-trimethyl-1-[(3-methylbutyl)sulfanyl]hept-6-en-4-yn-3-ol
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CAS No:
2,3,6-trimethyl-1-(3-methylbutylsulfanyl)hept-6-en-4-yn-3-ol Basic Attributes
254.4 g/mol
254.17043662 g/mol
Computed Properties
Molecular Weight:254.4
XLogP3:4.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:8
Exact Mass:254.17043662
Monoisotopic Mass:254.17043662
Topological Polar Surface Area:45.5
Heavy Atom Count:17
Complexity:307
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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