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Substance Name: 1,4-Naphthalenedione, 2-chloro-3-ethoxy- (9CI)
RN: 59641-32-6
InChIKey: YLULGOCHLLLHOM-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H9-Cl-O3

Molecular Weight

  • 236.653
 
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Names and Synonyms

Synonyms

  • 2-Chloro-3-ethoxy-1,4-naphthalenedione
  • 2-Chloro-3-ethoxy-1,4-naphthoquinone
  • 4-08-00-02364 (Beilstein Handbook Reference)
  • BRN 2264718

Systematic Names

  • 1,4-Naphthalenedione, 2-chloro-3-ethoxy- (9CI)
  • 1,4-Naphthoquinone, 2-chloro-3-ethoxy-

Registry Numbers

CAS Registry Number

  • 59641-32-6

System Generated Number

  • 0059641326

Structure Descriptors

InChI

1S/C12H9ClO3/c1-2-16-12-9(13)10(14)7-5-3-4-6-8(7)11(12)15/h3-6H,2H2,1H3

InChIKey

YLULGOCHLLLHOM-UHFFFAOYSA-N

Smiles

c12c(C(C(Cl)=C(C1=O)OCC)=O)cccc2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 16mg/kg (16mg/kg)   Journal of Medicinal Chemistry. Vol. 26, Pg. 570, 1983.