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Substance Name: Glutaric acid, alpha-butylbenzyl ester
RN: 50802-76-1
InChIKey: BPPZLCOVTJPHFG-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H22-O4

Molecular Weight

  • 278.3458
 
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Names and Synonyms

Synonyms

  • AF 457
  • alpha-Butylbenzyl ester of glutaric acid
  • BRN 2565733

Systematic Name

  • Glutaric acid, alpha-butylbenzyl ester

Registry Numbers

CAS Registry Number

  • 50802-76-1

System Generated Number

  • 0050802761

Structure Descriptors

InChI

1S/C16H22O4/c1-2-3-10-14(13-8-5-4-6-9-13)20-16(19)12-7-11-15(17)18/h4-6,8-9,14H,2-3,7,10-12H2,1H3,(H,17,18)

InChIKey

BPPZLCOVTJPHFG-UHFFFAOYSA-N

Smiles

CCCCC(c1ccccc1)OC(=O)CCCC(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 296mg/kg (296mg/kg) BEHAVIORAL: ANTIPSYCHOTIC

BEHAVIORAL: STIFFNESS
Bollettino Chimico Farmaceutico. Vol. 100, Pg. 855, 1961.