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Substance Name: AI 3-32678
RN: 6118-51-0
InChIKey: QQYNRBAAQFZCLF-UHFFFAOYSA-N

Molecular Formula

  • C8-H6-O4

Molecular Weight

  • 166.1314
 
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Names and Synonyms

Results Name

  • AI 3-32678

Synonyms

  • 3a-alpha,4-beta,7-beta,7a-alpha-Tetrahydro-4,7-epoxyisobenzofuran-1,3-dione
  • AI3-32678

Systematic Name

  • 4,7-Epoxyisobenzofuran-1,3-dione, 3a,4,7,7a-tetrahydro-, (3a-alpha,4-beta,7-beta,7a-alpha)-

Registry Numbers

CAS Registry Number

  • 6118-51-0

System Generated Number

  • 0006118510

Structure Descriptors

InChI

1S/C8H6O4/c9-7-5-3-1-2-4(11-3)6(5)8(10)12-7/h1-6H

InChIKey

QQYNRBAAQFZCLF-UHFFFAOYSA-N

Smiles

C1=CC2C3C(C1O2)C(=O)OC3=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 16mg/kg (16mg/kg)   Chemical Research in Toxicology. Vol. 3, Pg. 318, 1990.