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Substance Name: Picolinic acid, 5-(4-chlorobutoxy)-, 5-indanyl ester
RN: 72133-46-1
InChIKey: SOHXCFMYNTWRCV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H20-Cl-N-O3

Molecular Weight

  • 345.824
 
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Names and Synonyms

Synonyms

  • 2-Pyridinecarboxylic acid, 5-(4-chlorobutoxy)-, 2,3-dihydro-1H-inden-5-yl ester
  • 5-Indanyl 5-(4-chlorobutoxy)picolinate

Systematic Name

  • Picolinic acid, 5-(4-chlorobutoxy)-, 5-indanyl ester

Registry Numbers

CAS Registry Number

  • 72133-46-1

System Generated Number

  • 0072133461

Structure Descriptors

InChI

1S/C19H20ClNO3/c20-10-1-2-11-23-17-8-9-18(21-13-17)19(22)24-16-7-6-14-4-3-5-15(14)12-16/h6-9,12-13H,1-5,10-11H2

InChIKey

SOHXCFMYNTWRCV-UHFFFAOYSA-N

Smiles

c1cc2c(cc1OC(=O)c3ccc(cn3)OCCCCCl)CCC2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 300mg/kg (300mg/kg)   Journal of Pharmacobio-Dynamics. Vol. 6, Pg. 922, 1983.
mouse LD50 oral > 800mg/kg (800mg/kg)   Journal of Pharmacobio-Dynamics. Vol. 6, Pg. 922, 1983.