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Substance Name: 1,4-Naphthalenedione, 2-chloro-3-propoxy- (9CI)
RN: 84369-93-7
InChIKey: LHRLRJXHMDGYQJ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H11-Cl-O3

Molecular Weight

  • 250.68
 
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Names and Synonyms

Synonyms

  • 2-Chloro-3-propoxy-1,4-naphthalenedione
  • 2-Chloro-3-propoxy-1,4-naphthoquinone
  • BRN 5938700

Systematic Names

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

Registry Numbers

CAS Registry Number

  • 84369-93-7

System Generated Number

  • 0084369937

Structure Descriptors

InChI

1S/C13H11ClO3/c1-2-7-17-13-10(14)11(15)8-5-3-4-6-9(8)12(13)16/h3-6H,2,7H2,1H3

InChIKey

LHRLRJXHMDGYQJ-UHFFFAOYSA-N

Smiles

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

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 20mg/kg (20mg/kg)   Journal of Medicinal Chemistry. Vol. 26, Pg. 570, 1983.