[5-bromo-2-(5-bromo-4-chloro-1,2-dihydroxy-4-methylcyclohexyl)-2,6,6-trimethyloxan-3-yl] acetate
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[5-bromo-2-(5-bromo-4-chloro-1,2-dihydroxy-4-methylcyclohexyl)-2,6,6-trimethyloxan-3-yl] acetate
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CAS No:
72926-49-9
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Formula:
C17H27Br2ClO5
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Chemical Name:
[5-bromo-2-(5-bromo-4-chloro-1,2-dihydroxy-4-methylcyclohexyl)-2,6,6-trimethyloxan-3-yl] acetate
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Synonyms:
72926-49-9;Dihydroxydeodactol monoacetate;DTXSID60330971;NSC341594;NSC-341594;[5-bromo-2-(5-bromo-4-chloro-1,2-dihydroxy-4-methylcyclohexyl)-2,6,6-trimethyloxan-3-yl] acetate;DEODACTOL, DIHYDROXY MONOACETATE B704730K436
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CAS No:
[5-bromo-2-(5-bromo-4-chloro-1,2-dihydroxy-4-methylcyclohexyl)-2,6,6-trimethyloxan-3-yl] acetate Basic Attributes
506.7 g/mol
505.98933 g/mol
341594
DTXSID60330971
Computed Properties
Molecular Weight:506.7
XLogP3:2.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:505.98933
Monoisotopic Mass:503.99138
Topological Polar Surface Area:76
Heavy Atom Count:25
Complexity:547
Undefined Atom Stereocenter Count:7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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