(2R,3R,5R)-5-Bromo-2-[(1S,3R,4R)-4-bromo-3-chloro-4-methylcyclohexyl]tetrahydro-2,6,6-trimethyl-2H-pyran-3-ol
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![(2R,3R,5R)-5-Bromo-2-[(1S,3R,4R)-4-bromo-3-chloro-4-methylcyclohexyl]tetrahydro-2,6,6-trimethyl-2H-pyran-3-ol structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/18d1badc6bf742f585ee2a88023e1614.png "(2R,3R,5R)-5-Bromo-2-[(1S,3R,4R)-4-bromo-3-chloro-4-methylcyclohexyl]tetrahydro-2,6,6-trimethyl-2H-pyran-3-ol")
(2R,3R,5R)-5-Bromo-2-[(1S,3R,4R)-4-bromo-3-chloro-4-methylcyclohexyl]tetrahydro-2,6,6-trimethyl-2H-pyran-3-ol
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CAS No:
53915-39-2
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Formula:
C15H25Br2ClO2
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Chemical Name:
(2R,3R,5R)-5-Bromo-2-[(1S,3R,4R)-4-bromo-3-chloro-4-methylcyclohexyl]tetrahydro-2,6,6-trimethyl-2H-pyran-3-ol
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Synonyms:
2H-Pyran-3-ol,5-bromo-2-[(1S,3R,4R)-4-bromo-3-chloro-4-methylcyclohexyl]tetrahydro-2,6,6-trimethyl-,(2R,3R,5R)-;2H-Pyran-3-ol,5-bromo-2-(4-bromo-3-chloro-4-methylcyclohexyl)tetrahydro-2,6,6-trimethyl-,[2R-[2α(1S*,3R*,4R*),3α,5β]]-;(2R,3R,5R)-5-Bromo-2-[(1S,3R,4R)-4-bromo-3-chloro-4-methylcyclohexyl]tetrahydro-2,6,6-trimethyl-2H-pyran-3-ol;Isocespitol;Isocaespitol
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CAS No:
(2R,3R,5R)-5-Bromo-2-[(1S,3R,4R)-4-bromo-3-chloro-4-methylcyclohexyl]tetrahydro-2,6,6-trimethyl-2H-pyran-3-ol Basic Attributes
432.6188
432.62
DTXSID40558792
Computed Properties
Molecular Weight:432.6
XLogP3:4.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:431.98893
Monoisotopic Mass:429.99098
Topological Polar Surface Area:29.5
Heavy Atom Count:20
Complexity:379
Defined Atom Stereocenter Count:6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
(2R,3R,5R)-5-Bromo-2-[(1S,3R,4R)-4-bromo-3-chloro-4-methylcyclohexyl]tetrahydro-2,6,6-trimethyl-2H-pyran-3-ol
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