4-Oxobedfordiaic acid
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4-Oxobedfordiaic acid
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CAS No:
68799-38-2
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Formula:
C15H22O3
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Chemical Name:
4-Oxobedfordiaic acid
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Synonyms:
4-Oxobedfordiaic acid;(1R-cis)-5-Methyl-alpha-methylene-4-(3-oxobutyl)-3-cycloheptene-1-acetic acid
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CAS No:
Computed Properties
Molecular Weight:250.33
XLogP3:2.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:250.15689456
Monoisotopic Mass:250.15689456
Topological Polar Surface Area:54.4
Heavy Atom Count:18
Complexity:379
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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