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Substance Name: Picolinic acid, 5-butoxy-, 1-hydroxyethyl ester, ester with pivalic acid
RN: 66933-12-8
InChIKey: NKJAVSNPXUGVLF-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H25-N-O5

Molecular Weight

  • 323.3865
 
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Names and Synonyms

Synonyms

  • 1-Hydroxyethyl 5-butoxypicolinate ester with pivalic acid
  • 2-Pyridinecarboxylic acid, 5-butoxy-, 1-(2,2-dimethyl-1-oxopropoxy)ethyl ester
  • BRN 0426434

Systematic Name

  • Picolinic acid, 5-butoxy-, 1-hydroxyethyl ester, ester with pivalic acid

Registry Numbers

CAS Registry Number

  • 66933-12-8

System Generated Number

  • 0066933128

Structure Descriptors

InChI

1S/C17H25NO5/c1-6-7-10-21-13-8-9-14(18-11-13)15(19)22-12(2)23-16(20)17(3,4)5/h8-9,11-12H,6-7,10H2,1-5H3

InChIKey

NKJAVSNPXUGVLF-UHFFFAOYSA-N

Smiles

CCCCOc1ccc(nc1)C(=O)OC(C)OC(=O)C(C)(C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 200mg/kg (200mg/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.