Product Name

  • Name

    4,5-dihydroxy-10-oxo-9,10-dihydroanthracen-9-yl acetate

  • EINECS
  • CAS No. 117568-24-8
  • Density 1.48g/cm3
  • Solubility
  • Melting Point
  • Formula C16H12 O5
  • Boiling Point 462.2°Cat760mmHg
  • Molecular Weight 284.28
  • Flash Point 174.6°C
  • Transport Information
  • Appearance
  • Safety A poison by ingestion. A skin irritant. Mutation data reported. When heated to decomposition it emits acrid smoke and irritating vapors.
  • Risk Codes
  • Molecular Structure Molecular Structure of 117568-24-8 (4,5-dihydroxy-10-oxo-9,10-dihydroanthracen-9-yl acetate)
  • Hazard Symbols A poison. A skin irritant.
  • Synonyms 10-Acetyldithranol
  • PSA
  • LogP

10-Acetyldithranol Chemical Properties

Product Name: 10-Acetyldithranol 
CAS Registry Number: 117568-24-8
Synonyms: 10-(Acetyloxy)-1,8-dihydroxy-9(10H)-anthracenone ; 10-Acetyldithranol ; 9(10H)-Anthracenone, 1,8-dihydroxy-10-(1-oxoethyl)- ; Dithranol, 10-acetyl- 
Systematic Name: 9(10H)-Anthracenone, 10-(acetyloxy)-1,8-dihydroxy- 
IUPAC Name: (4,5-dihydroxy-10-oxo-9H-anthracen-9-yl) acetate
Molecular Weight: 284.26348 [g/mol]
Molecular Formula: C16H12O5
XLogP3-AA: 2.7
H-Bond Donor: 2
H-Bond Acceptor: 5
Surface Tension: 75.7 dyne/cm
Density: 1.48 g/cm3
Flash Point: 174.6 °C
Enthalpy of Vaporization: 75.09 kJ/mol
Boiling Point: 462.2 °C at 760 mmHg
Vapour Pressure: 3.65E-09 mmHg at 25°C 
Following is the molecular structure of 10-Acetyldithranol (CAS NO.117568-24-8) is:

10-Acetyldithranol Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 oral 347mg/kg (347mg/kg) GASTROINTESTINAL: ULCERATION OR BLEEDING FROM SMALL INTESTINE

GASTROINTESTINAL: "HYPERMOTILITY, DIARRHEA"
Archives of Toxicology. Vol. 59, Pg. 180, 1986.

10-Acetyldithranol Safety Profile

A poison by ingestion. A skin irritant. Mutation data reported. When heated to decomposition it emits acrid smoke and irritating vapors.

10-Acetyldithranol Specification

Descriptors computed from structure, you can know some information about 10-Acetyldithranol (CAS NO.117568-24-8) :
Canonical SMILES: CC(=O)OC1C2=C(C(=CC=C2)O)C(=O)C3=C1C=CC=C3O
InChI: InChI=1S/C16H12O5/c1-8(17)21-16-9-4-2-6-11(18)13(9)15(20)14-10(16)5-3-7-
12(14)19/h2-7,16,18-19H,1H3
InChIKey: RVNNHFOSBVBNIE-UHFFFAOYSA-N
Exact Mass: 284.068473
MonoIsotopic Mass: 284.068473
Topological Polar Surface Area: 83.8
Heavy Atom Count: 21

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