3-[(3aS,4S,7aS)-7a-methyl-5-oxo-2,3,3a,4,6,7-hexahydro-1H-inden-4-yl]propanoic acid
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![3-[(3aS,4S,7aS)-7a-methyl-5-oxo-2,3,3a,4,6,7-hexahydro-1H-inden-4-yl]propanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/4f6d77ea863e4f52bda3723a87bf9e79.png "3-[(3aS,4S,7aS)-7a-methyl-5-oxo-2,3,3a,4,6,7-hexahydro-1H-inden-4-yl]propanoic acid")
3-[(3aS,4S,7aS)-7a-methyl-5-oxo-2,3,3a,4,6,7-hexahydro-1H-inden-4-yl]propanoic acid
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CAS No:
13349-15-0
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Formula:
C13H20O3
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Chemical Name:
3-[(3aS,4S,7aS)-7a-methyl-5-oxo-2,3,3a,4,6,7-hexahydro-1H-inden-4-yl]propanoic acid
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Synonyms:
perhydroindanpropionic acid;13349-15-0;DTXSID50928144;3-(7a-Methyl-5-oxooctahydro-1H-inden-4-yl)propanoic acid;(3aalpha,4alpha,7abeta)-Octahydro-7a-methyl-5-oxo-lH-indene-4-propanoic acid
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CAS No:
3-[(3aS,4S,7aS)-7a-methyl-5-oxo-2,3,3a,4,6,7-hexahydro-1H-inden-4-yl]propanoic acid Basic Attributes
224.30 g/mol
224.14124450 g/mol
Computed Properties
Molecular Weight:224.30
XLogP3:2.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:224.14124450
Monoisotopic Mass:224.14124450
Topological Polar Surface Area:54.4
Heavy Atom Count:16
Complexity:310
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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