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Substance Name: Pyrimidine, 3,4,5,6-tetrahydro-2-(4-chloro-alpha-ethoxybenzyl)-5,5-dimethyl-
RN: 33267-71-9
InChIKey: NKZQEKLNOVBFRX-UHFFFAOYSA-N

Molecular Formula

  • C15-H21-Cl-N2-O

Molecular Weight

  • 280.797
 
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Names and Synonyms

Synonyms

  • 2-(4-Chloro-alpha-ethoxybenzyl)-5,5-dimethyl-3,4,5,6-tetrahydropyrimidine
  • 2-(p-Chloro-alpha-ethoxybenzyl)-5,5-dimethyl-3,4,5,6-tetrahydropyrimidine
  • 3,4,5,6-Tetrahydro-2-(4-chloro-alpha-ethoxybenzyl)-5,5-dimethylpyrimidine
  • 3,4,5,6-Tetrahydro-2-(p-chloro-alpha-ethoxybenzyl)-5,5-dimethylpyrimidine
  • 5-23-11-00411 (Beilstein Handbook Reference)
  • BRN 0813219

Systematic Name

  • Pyrimidine, 3,4,5,6-tetrahydro-2-(4-chloro-alpha-ethoxybenzyl)-5,5-dimethyl-

Registry Numbers

CAS Registry Number

  • 33267-71-9

System Generated Number

  • 0033267719

Structure Descriptors

InChI

1S/C15H21ClN2O/c1-4-19-13(11-5-7-12(16)8-6-11)14-17-9-15(2,3)10-18-14/h5-8,13H,4,9-10H2,1-3H3,(H,17,18)

InChIKey

NKZQEKLNOVBFRX-UHFFFAOYSA-N

Smiles

C1(=NCC(CN1)(C)C)[C@@H](c1ccc(cc1)Cl)OCC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 oral 190mg/kg (190mg/kg)   Journal of Medicinal Chemistry. Vol. 17, Pg. 702, 1974.