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Substance Name: 1-Methoxy-9,10-anthracenedione
RN: 82-39-3
UNII: 3I7WM10A1M
InChIKey: CQGDBBBZCJYDRY-UHFFFAOYSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C15-H10-O3

Molecular Weight

  • 238.241
 
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Names and Synonyms

Name of Substance

  • 1-Methoxy-9,10-anthracenedione

Synonyms

  • 1-Methoxy-9,10-anthracenedione
  • 1-Methoxy-9,10-anthraquinone
  • 1-Methoxyanthraquinone
  • 4-08-00-02586 (Beilstein Handbook Reference)
  • BRN 1880353
  • CCRIS 5615
  • EINECS 201-418-8
  • NSC 400205
  • UNII-3I7WM10A1M

Systematic Names

  • 1-Methoxyanthraquinone
  • 9,10-Anthracenedione, 1-methoxy-
  • Anthraquinone, 1-methoxy-

Registry Numbers

CAS Registry Number

  • 82-39-3

FDA UNII

  • 3I7WM10A1M

System Generated Number

  • 0000082393

Structure Descriptors

InChI

1S/C15H10O3/c1-18-12-8-4-7-11-13(12)15(17)10-6-3-2-5-9(10)14(11)16/h2-8H,1H3

InChIKey

CQGDBBBZCJYDRY-UHFFFAOYSA-N

Smiles

c12c(C(c3ccccc3C1=O)=O)cccc2OC

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 3.430 (none)   EST
Water Solubility 2.530 mg/L 25 EST
Vapor Pressure 2.76E-07 mm Hg 25 EXP
Henry's Law Constant 1.88E-10 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 9.84E-12 cm3/molecule-sec 25 EST

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