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4-Hydroxymellein

4-Hydroxymellein structure

4-Hydroxymellein 

structure
  • CAS No:

    33788-22-6

  • Formula:

    C10H10O4

  • Chemical Name:

    4-Hydroxymellein

  • Synonyms:

    1H-2-Benzopyran-1-one,3,4-dihydro-4,8-dihydroxy-3-methyl-;Isocoumarin,3,4-dihydro-4,8-dihydroxy-3-methyl-;3,4-Dihydro-4,8-dihydroxy-3-methyl-1H-2-benzopyran-1-one;4-Hydroxymellein;37712-35-9

Description

Solid


4-hydroxymellein is an isochromane that is mellein bearing a hydroxy group at position 4. It has a role as an antifungal agent, a fungal metabolite, a plant metabolite, an animal metabolite and an antimicrobial agent. It is a member of isochromanes, a member of phenols and a delta-lactone. It derives from a mellein.

4-Hydroxymellein Basic Attributes

194.18 g/mol

194.18

Characteristics

66.8 Ų

109-109.5 °C

Drug Information

4-hydroxymellein

Computed Properties

Molecular Weight:194.18
XLogP3:1.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Exact Mass:194.05790880
Monoisotopic Mass:194.05790880
Topological Polar Surface Area:66.8
Heavy Atom Count:14
Complexity:240
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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