6-Ethylthio-3-hepten-2-one
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6-Ethylthio-3-hepten-2-one
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CAS No:
81008-52-8
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Formula:
C9H16OS
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Chemical Name:
6-Ethylthio-3-hepten-2-one
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Synonyms:
6-ethylthio-3-hepten-2-one;(E)-6-ethylsulfanylhept-3-en-2-one;SCHEMBL2990400;008E528
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CAS No:
Computed Properties
Molecular Weight:172.29
XLogP3:2.1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:5
Exact Mass:172.09218630
Monoisotopic Mass:172.09218630
Topological Polar Surface Area:42.4
Heavy Atom Count:11
Complexity:141
Undefined Atom Stereocenter Count:1
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes