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Substance Name: Spiro(cyclohexane-1,2'-benzodioxole)-2-acetic acid
RN: 50836-02-7
InChIKey: YHIWZWLMDOWBRY-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H16-O4

Molecular Weight

  • 248.2764
 
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Names and Synonyms

  • Spiro(cyclohexane-1,2'-benzodioxole)-2-acetic acid

Registry Numbers

CAS Registry Number

  • 50836-02-7

System Generated Number

  • 0050836027

Structure Descriptors

InChI

1S/C14H16O4/c15-13(16)9-10-5-3-4-8-14(10)17-11-6-1-2-7-12(11)18-14/h1-2,6-7,10H,3-5,8-9H2,(H,15,16)

InChIKey

YHIWZWLMDOWBRY-UHFFFAOYSA-N

Smiles

c1ccc2c(c1)OC3(O2)CCCCC3CC(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 450mg/kg (450mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 11, Pg. 539, 1976.