3,4-Dihydro-8-hydroxy-3-methylisocoumarin
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3,4-Dihydro-8-hydroxy-3-methylisocoumarin
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CAS No:
1200-93-7
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Formula:
C10H10O3
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Chemical Name:
3,4-Dihydro-8-hydroxy-3-methylisocoumarin
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Synonyms:
1H-2-Benzopyran-1-one,3,4-dihydro-8-hydroxy-3-methyl-;Isocoumarin,3,4-dihydro-8-hydroxy-3-methyl-,(±)-;1H-2-Benzopyran-1-one,3,4-dihydro-8-hydroxy-3-methyl-,(±)-;3,4-Dihydro-8-hydroxy-3-methyl-1H-2-benzopyran-1-one;(±)-Mellein;3-Methyl-8-hydroxy-3,4-dihydro-1H-2-benzopyran-1-one;3,4-Dihydro-8-hydroxy-3-methylisocoumarin;17397-85-2
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CAS No:
Description
Mellein is an isochromane that is 3,4-dihydroisocoumarin bearing methyl and hydroxy substituents at positions 3 and 8 respectively. It derives from an isocoumarin.
Computed Properties
Molecular Weight:178.18
XLogP3:2.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Exact Mass:178.062994177
Monoisotopic Mass:178.062994177
Topological Polar Surface Area:46.5
Heavy Atom Count:13
Complexity:214
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
3,4-Dihydro-8-hydroxy-3-methylisocoumarin
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