Apocynol A
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Apocynol A
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CAS No:
358721-33-2
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Formula:
C13H20O3
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Chemical Name:
Apocynol A
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Synonyms:
Apocynol A;(4R)-4-[(1E,3R)-3-Hydroxy-1-buten-1-yl]-3-(hydroxymethyl)-5,5-dimethyl-2-cyclohexen-1-one
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CAS No:
Computed Properties
Molecular Weight:224.30
XLogP3:0.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:224.14124450
Monoisotopic Mass:224.14124450
Topological Polar Surface Area:57.5
Heavy Atom Count:16
Complexity:326
Defined Atom Stereocenter Count:2
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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