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Substance Name: 1,3-Naphthalenediol, 4,4'-methylenedi-
RN: 68828-44-4
InChIKey: JVNQHANPPGWIDR-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H16-O4

Molecular Weight

  • 332.353
 
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Names and Synonyms

Synonyms

  • 0-06-00-01182 (Beilstein Handbook Reference)
  • 4,4'-Methylenebis(1,3-naphthalenediol)
  • BRN 2305804

Systematic Name

  • 1,3-Naphthalenediol, 4,4'-methylenedi-

Registry Numbers

CAS Registry Number

  • 68828-44-4

System Generated Number

  • 0068828444

Structure Descriptors

InChI

1S/C21H16O4/c22-18-10-20(24)16(12-5-1-3-7-14(12)18)9-17-13-6-2-4-8-15(13)19(23)11-21(17)25/h1-8,10-11,22-25H,9H2

InChIKey

JVNQHANPPGWIDR-UHFFFAOYSA-N

Smiles

c12c(Cc3c4c(c(O)cc3O)cccc4)c(cc(c1cccc2)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 227mg/kg (227mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 13, Pg. 381, 1978.