(4S,5R)-5-hydroxy-4-methylheptan-3-one
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(4S,5R)-5-hydroxy-4-methylheptan-3-one
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CAS No:
71699-35-9
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Formula:
C8H16O2
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Chemical Name:
(4S,5R)-5-hydroxy-4-methylheptan-3-one
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Synonyms:
sitophilure;sitophilure, (R*,R*)-isomer;sitophilure, (R-(R*,R*))-isomer;sitophilure, (R-(R*,S*))-isomer;sitophilure, (S(R*,R*))-isomer;sitophilure, (S-(R*,S*))-isomer;Sitophilure;5R-Hydroxy-4S-methylheptan-3-one;(4S,5R)-5-hydroxy-4-methyl-3-heptanone;71699-35-9;5-Hydroxy-4-methylheptan-3-one;(+)-Sitophilure;(4S,5R)-5-hydroxy-4-methylheptan-3-one;SCHEMBL1535526;DTXSID90992309;ZINC5925886;LMFA12000093;(R*,S*)-5-Hydroxy-4-methyl-3-heptanone;5-Hydroxy-4-methyl-3-heptanone, (R*,S*)-;3-Heptanone, 5-hydroxy-4-methyl-, (R*,S*)-
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CAS No:
(4S,5R)-5-hydroxy-4-methylheptan-3-one Use and Manufacturing
Fatty Acyls [FA] -> Oxygenated hydrocarbons [FA12]
Computed Properties
Molecular Weight:144.21
XLogP3:1.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:144.115029749
Monoisotopic Mass:144.115029749
Topological Polar Surface Area:37.3
Heavy Atom Count:10
Complexity:110
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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