7,8-dimethyl-1-methylidene-2-oxo-4,4a,6a,7-tetrahydropentaleno[1,6a-c]pyran-5-carboxylic acid
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![7,8-dimethyl-1-methylidene-2-oxo-4,4a,6a,7-tetrahydropentaleno[1,6a-c]pyran-5-carboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/d5274ba6f8d54444a5f835289fd8fa2f.png "7,8-dimethyl-1-methylidene-2-oxo-4,4a,6a,7-tetrahydropentaleno[1,6a-c]pyran-5-carboxylic acid")
7,8-dimethyl-1-methylidene-2-oxo-4,4a,6a,7-tetrahydropentaleno[1,6a-c]pyran-5-carboxylic acid
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CAS No:
70857-52-2
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Formula:
C15H16O4
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Chemical Name:
7,8-dimethyl-1-methylidene-2-oxo-4,4a,6a,7-tetrahydropentaleno[1,6a-c]pyran-5-carboxylic acid
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Synonyms:
NSC145150;U 36699;70857-52-2;MLS002920651;PENTALENOPYRAN-5-CARBOXYLIC ACID DERIV;6,7-Dimethyl-4-methylene-3-oxo-1,3,4,7,7a,9a-hexahydropentaleno(1,6a-c)pyran-9-carboxylic acid;6,7-Dimethyl-4-methylene-3-oxo-1,3,4,7,7a,9a-hexahydropentaleno[1,6a-c]pyran-9-carboxylic acid;NSC 145150;6,7-dimethyl-4-methylidene-3-oxo-1,3,4,7,7a,9a-hexahydropentaleno[1,6a-c]pyran-9-carboxylic acid;CHEMBL1886641;DTXSID10991132;NSC-145150;NCI60_000978;SMR001798238;Pentalenopyran-5-carboxylic acid derivative;Pentaleno[1, 1,2,4,4a,6a,7-hexahydro-7,8-dimethyl-1-methylene-2-oxo-;7,8-dimethyl-1-methylene-2-oxo-4,4a,6a,7-tetrahydropentaleno[1,6a-c]pyran-5-carboxylic acid
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CAS No:
7,8-dimethyl-1-methylidene-2-oxo-4,4a,6a,7-tetrahydropentaleno[1,6a-c]pyran-5-carboxylic acid Basic Attributes
260.28 g/mol
260.10485899 g/mol
145150
Computed Properties
Molecular Weight:260.28
XLogP3:1.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:260.10485899
Monoisotopic Mass:260.10485899
Topological Polar Surface Area:63.6
Heavy Atom Count:19
Complexity:569
Undefined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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