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Substance Name: Benzoic acid, 4-((5-hydroxypentyl)oxy)-
RN: 98092-80-9
InChIKey: DSKAHWKQBWNZCK-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H16-O4

Molecular Weight

  • 224.2544
 
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Names and Synonyms

Synonyms

  • 4-((5-Hydroxypentyl)oxy)benzoic acid
  • CM 40937

Systematic Name

  • Benzoic acid, 4-((5-hydroxypentyl)oxy)-

Registry Numbers

CAS Registry Number

  • 98092-80-9

System Generated Number

  • 0098092809

Structure Descriptors

InChI

1S/C12H16O4/c13-8-2-1-3-9-16-11-6-4-10(5-7-11)12(14)15/h4-7,13H,1-3,8-9H2,(H,14,15)

InChIKey

DSKAHWKQBWNZCK-UHFFFAOYSA-N

Smiles

c1cc(ccc1C(=O)O)OCCCCCO

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 3gm/kg (3000mg/kg)   United States Patent Document. Vol. #4691043,