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Substance Name: 1(3H)-Isobenzofuranone, 3-butyl-3-hydroxy-
RN: 162050-42-2
UNII: R7Z7ETT3W3
InChIKey: PWRAUQMRDXDCHM-UHFFFAOYSA-N

Molecular Formula

  • C12-H14-O3

Molecular Weight

  • 206.2378
 
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Names and Synonyms

Name of Substance

  • 1(3H)-Isobenzofuranone, 3-butyl-3-hydroxy-

Synonyms

  • 1(3H)-Isobenzofuranone, 3-butyl-3-hydroxy-
  • 3-Butyl-3-hydroxy-1(3H)-isobenzofuranone
  • Butylphthalide metabolite M3-1
  • UNII-R7Z7ETT3W3

Registry Numbers

CAS Registry Number

  • 162050-42-2

FDA UNII

  • R7Z7ETT3W3

System Generated Number

  • 0162050422

Structure Descriptors

InChI

1S/C12H14O3/c1-2-3-8-12(14)10-7-5-4-6-9(10)11(13)15-12/h4-7,14H,2-3,8H2,1H3

InChIKey

PWRAUQMRDXDCHM-UHFFFAOYSA-N

Smiles

CCCCC1(O)OC(=O)c2ccccc12