(1R,5R,6R)-3-tert-butyl-5-hydroxy-7-oxabicyclo[4.1.0]hept-3-en-2-one
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![(1R,5R,6R)-3-tert-butyl-5-hydroxy-7-oxabicyclo[4.1.0]hept-3-en-2-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/3296294d4adf4bfab4705f682ca99105.png "(1R,5R,6R)-3-tert-butyl-5-hydroxy-7-oxabicyclo[4.1.0]hept-3-en-2-one")
(1R,5R,6R)-3-tert-butyl-5-hydroxy-7-oxabicyclo[4.1.0]hept-3-en-2-one
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CAS No:
158592-93-9
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Formula:
C10H14O3
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Chemical Name:
(1R,5R,6R)-3-tert-butyl-5-hydroxy-7-oxabicyclo[4.1.0]hept-3-en-2-one
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Synonyms:
6-tert-butyl-2,3-epoxy-1,4-benzoquinone;6-tert-butyl-2,3-epoxy-1,4-benzoquinone, 1R-(1alpha,5alpha,6alpha)-isomer;TBE-BQ;158592-93-9;Tbe-BQ;6-tert-Butyl-2,3-epoxy-1,4-benzoquinone;(4R)-TBEH;DTXSID70935951;3-tert-Butyl-5-hydroxy-7-oxabicyclo[4.1.0]hept-3-en-2-one
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CAS No:
(1R,5R,6R)-3-tert-butyl-5-hydroxy-7-oxabicyclo[4.1.0]hept-3-en-2-one Basic Attributes
182.22 g/mol
182.094294304 g/mol
Computed Properties
Molecular Weight:182.22
XLogP3:0.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:182.094294304
Monoisotopic Mass:182.094294304
Topological Polar Surface Area:49.8
Heavy Atom Count:13
Complexity:285
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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