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Substance Name: Pyrimidine, 3,4,5,6-tetrahydro-2-(3,4-dichloro-alpha-ethoxybenzyl)-
RN: 33235-96-0
InChIKey: KWYDMASCDYCJRP-UHFFFAOYSA-N

Molecular Formula

  • C13-H16-Cl2-N2-O

Molecular Weight

  • 287.188
 
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Names and Synonyms

Synonyms

  • 2-(3,4-Dichloro-alpha-ethoxybenzyl)-3,4,5,6-tetrahydropyrimidine
  • 3,4,5,6-Tetrahydro-2-(3,4-dichloro-alpha-ethoxybenzyl)pyrimidine
  • 5-23-11-00391 (Beilstein Handbook Reference)
  • BRN 0803219

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 33235-96-0

System Generated Number

  • 0033235960

Structure Descriptors

InChI

1S/C13H16Cl2N2O/c1-2-18-12(13-16-6-3-7-17-13)9-4-5-10(14)11(15)8-9/h4-5,8,12H,2-3,6-7H2,1H3,(H,16,17)

InChIKey

KWYDMASCDYCJRP-UHFFFAOYSA-N

Smiles

C1(=NCCCN1)[C@@H](c1cc(Cl)c(cc1)Cl)OCC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 oral 370mg/kg (370mg/kg)   Journal of Medicinal Chemistry. Vol. 17, Pg. 702, 1974.