[5E,(+)]-2-Methyl-6-[(1S)-3-methyl-2α-(3-methyl-1-oxo-2-butenyl)-3-cyclohexene-1α-yl]-2,5-heptadiene-4-one
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![[5E,(+)]-2-Methyl-6-[(1S)-3-methyl-2α-(3-methyl-1-oxo-2-butenyl)-3-cyclohexene-1α-yl]-2,5-heptadiene-4-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/bc7a62833efb4343a5f581e48dc78e16.png "[5E,(+)]-2-Methyl-6-[(1S)-3-methyl-2α-(3-methyl-1-oxo-2-butenyl)-3-cyclohexene-1α-yl]-2,5-heptadiene-4-one")
[5E,(+)]-2-Methyl-6-[(1S)-3-methyl-2α-(3-methyl-1-oxo-2-butenyl)-3-cyclohexene-1α-yl]-2,5-heptadiene-4-one
structure -
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CAS No:
71539-59-8
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Formula:
C20H28O2
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Chemical Name:
[5E,(+)]-2-Methyl-6-[(1S)-3-methyl-2α-(3-methyl-1-oxo-2-butenyl)-3-cyclohexene-1α-yl]-2,5-heptadiene-4-one
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Synonyms:
(+)-Bis-trans-ocimenone;(5E)-2-Methyl-6-[(1S)-3-methyl-2α-(3-methyl-1-oxo-2-butenyl)-3-cyclohexen-1α-yl]-2,5-heptadien-4-one;[5E,(+)]-2-Methyl-6-[(1S)-3-methyl-2α-(3-methyl-1-oxo-2-butenyl)-3-cyclohexen-1α-yl]-2,5-heptadien-4-one;[5E,(+)]-2-Methyl-6-[(1S)-3-methyl-2α-(3-methyl-1-oxo-2-butenyl)-3-cyclohexene-1α-yl]-2,5-heptadiene-4-one;Bis-trans-Ocimenone
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CAS No:
[5E,(+)]-2-Methyl-6-[(1S)-3-methyl-2α-(3-methyl-1-oxo-2-butenyl)-3-cyclohexene-1α-yl]-2,5-heptadiene-4-one Basic Attributes
300.43512
300.209
Computed Properties
Molecular Weight:300.4
XLogP3:5
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:5
Exact Mass:300.208930132
Monoisotopic Mass:300.208930132
Topological Polar Surface Area:34.1
Heavy Atom Count:22
Complexity:563
Defined Atom Stereocenter Count:2
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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