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Substance Name: Benzoic acid, 2-(allyloxy)-3,5-dipropyl-
RN: 7192-46-3
InChIKey: BVCJNCQYOHKMQL-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H22-O3

Molecular Weight

  • 262.347
 
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Names and Synonyms

Synonyms

  • 2-Allyloxy-3,5-dipropylbenzoic acid
  • BRN 2622031

Systematic Name

  • Benzoic acid, 2-(allyloxy)-3,5-dipropyl-

Registry Numbers

CAS Registry Number

  • 7192-46-3

System Generated Number

  • 0007192463

Structure Descriptors

InChI

1S/C16H22O3/c1-4-7-12-10-13(8-5-2)15(19-9-6-3)14(11-12)16(17)18/h6,10-11H,3-5,7-9H2,1-2H3,(H,17,18)

InChIKey

BVCJNCQYOHKMQL-UHFFFAOYSA-N

Smiles

c1(c(cc(CCC)cc1C(O)=O)CCC)OCC=C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 650mg/kg (650mg/kg) BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY)

BEHAVIORAL: ALTERED SLEEP TIME (INCLUDING CHANGE IN RIGHTING REFLEX)
Journal of Medicinal and Pharmaceutical Chemistry. Vol. 2, Pg. 213, 1960.