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Substance Name: Benzeneacetic acid, 4-(1,3-dioxan-2-yl)-
RN: 43153-18-0
InChIKey: TYLYMTQVHRTRCO-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H12-O4

Molecular Weight

  • 222.2386
 
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Names and Synonyms

Synonyms

  • 4-(1,3-Dioxan-2-yl)benzeneacetic acid
  • Acide (dioxanne-2,6)-4 phenylacetique
  • Acide (dioxanne-2,6)-4 phenylacetique [French]

Systematic Name

  • Benzeneacetic acid, 4-(1,3-dioxan-2-yl)-

Registry Numbers

CAS Registry Number

  • 43153-18-0

System Generated Number

  • 0043153180

Structure Descriptors

InChI

1S/C12H14O4/c13-11(14)8-9-2-4-10(5-3-9)12-15-6-1-7-16-12/h2-5,12H,1,6-8H2,(H,13,14)

InChIKey

TYLYMTQVHRTRCO-UHFFFAOYSA-N

Smiles

c1cc(ccc1CC(=O)O)C2OCCCO2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 unreported > 200mg/kg (200mg/kg)   French Demande Patent Document. Vol. #2134197,