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Substance Name: 1,4-Dihydroxy-9,10-anthracenedione
RN: 81-64-1
UNII: 8S496ZV3CS
InChIKey: GUEIZVNYDFNHJU-UHFFFAOYSA-N

Classification Codes

  • Mutation Data
  • Skin / Eye Irritant

Molecular Formula

  • C14-H8-O4

Molecular Weight

  • 240.213
 
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Names and Synonyms

Name of Substance

  • 1,4-Dihydroxy-9,10-anthracenedione
  • 1,4-Dihydroxyanthraquinone

Synonyms

  • 1,4-Dihydroxy-9,10-anthracenedione
  • 1,4-Dihydroxy-9,10-anthraquinone
  • 1,4-Dihydroxyanthrachinon
  • 1,4-Dihydroxyanthrachinon [Czech]
  • 1,4-Dihydroxyanthraquinone
  • 1,4-Dioxyanthraquinone
  • 1,4-Dioxyanthraquinone [Russian]
  • 1,4-Doa
  • 1,4-Doa [Russian]
  • 9,10-Anthracenedione, 1,4-dihydroxy-
  • AI3-17616
  • Anthraquinone, 1,4-dihydroxy-
  • C.I. 58050
  • CCRIS 3524
  • Chinizarin
  • CI 58050
  • EC 201-368-7
  • EINECS 201-368-7
  • HSDB 5242
  • Macrolex Orange GG
  • NSC 15367
  • NSC 646569
  • Quinizarin
  • Quinizarine
  • Smoke Orange R
  • Solvent Orange 86
  • UNII-8S496ZV3CS

Systematic Names

  • 1,4-Dihydroxyanthraquinone
  • 9,10-Anthracenedione, 1,4-dihydroxy-
  • Anthraquinone, 1,4-dihydroxy-

Superlist Name

  • 1,4-Dihydroxy-9,10-anthracenedione

Registry Numbers

CAS Registry Number

  • 81-64-1

FDA UNII

  • 8S496ZV3CS

Other Registry Number

  • 103220-12-8

System Generated Number

  • 0000081641

Structure Descriptors

InChI

1S/C14H8O4/c15-9-5-6-10(16)12-11(9)13(17)7-3-1-2-4-8(7)14(12)18/h1-6,15-16H

InChIKey

GUEIZVNYDFNHJU-UHFFFAOYSA-N

Smiles

c12c(C(c3ccccc3C1=O)=O)c(ccc2O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 10gm/kg (10000mg/kg)   Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 55(7), Pg. 93, 1990.
mouse LD50 intravenous 320mg/kg (320mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#03274,
rat LD50 intraperitoneal 2100mg/kg (2100mg/kg)   Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 21(12), Pg. 27, 1977.
rat LD50 oral > 5gm/kg (5000mg/kg)   National Technical Information Service. Vol. AD-A067-313,

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 200 deg C   EXP
log P (octanol-water) 3.940 (none)   EST
Water Solubility 0.0961 mg/L 25 EXP
Vapor Pressure 2.43E-08 mm Hg 25 EXP
Henry's Law Constant 7.99E-08 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 9.85E-12 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.