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Substance Name: p-Cymene-2-carboxylic acid, 3-(2-(dimethylamino)ethoxy)-, isobutyl ester
RN: 53206-74-9
InChIKey: SYFXJBNDAATWMO-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H31-N-O3

Molecular Weight

  • 321.458
 
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Names and Synonyms

Synonyms

  • BRN 2751323
  • Isobutyl 3-(2-(dimethylamino)ethoxy)-p-cymene-2-carboxylate

Systematic Name

  • p-Cymene-2-carboxylic acid, 3-(2-(dimethylamino)ethoxy)-, isobutyl ester

Registry Numbers

CAS Registry Number

  • 53206-74-9

System Generated Number

  • 0053206749

Structure Descriptors

InChI

1S/C19H31NO3/c1-13(2)12-23-19(21)17-15(5)8-9-16(14(3)4)18(17)22-11-10-20(6)7/h8-9,13-14H,10-12H2,1-7H3

InChIKey

SYFXJBNDAATWMO-UHFFFAOYSA-N

Smiles

c1(c(c(ccc1C(C)C)C)C(OCC(C)C)=O)OCCN(C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 30mg/kg (30mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 9, Pg. 156, 1974.