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Home > Encyclopedia > 3-N-butyl-4,5-dihydrophthalide

3-N-butyl-4,5-dihydrophthalide

3-N-butyl-4,5-dihydrophthalide structure

3-N-butyl-4,5-dihydrophthalide 

structure
  • CAS No:

    62006-39-7

  • Formula:

    C12H16O2

  • Chemical Name:

    3-N-butyl-4,5-dihydrophthalide

  • Synonyms:

    3-N-butyl-4,5-dihydrophthalide;3-butyl-4,5-dihydro-3H-isobenzofuran-1-one;Senkyunolide A (=3-butyl-4,5-dihydro-3H-2-benzofuran-1-one);(3S)-3-butyl-4,5-dihydro-3H-isobenzofuran-1-one

  • Categories:

    Biochemical Engineering  >  Plant Extracts

3-N-butyl-4,5-dihydrophthalide Basic Attributes

192.258

192.115036

Characteristics

26.30000

2.48

1.1±0.1 g/cm3

368.1±11.0 °C at 760 mmHg

154.2±16.7 °C

1.521

Drug Information

3-N-butyl-4,5-dihydrophthalide

Computed Properties

Molecular Weight:192.25
XLogP3:2.7
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:192.115029749
Monoisotopic Mass:192.115029749
Topological Polar Surface Area:26.3
Heavy Atom Count:14
Complexity:299
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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