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Basic Information
CAS No.: 7213-59-4
Name: 6-Methoxy-3-methyl-1,7,8-trihydroxy-9,10-anthraquinone
Molecular Structure:
Molecular Structure of 7213-59-4 (6-Methoxy-3-methyl-1,7,8-trihydroxy-9,10-anthraquinone)
Formula: C16H12O6
Molecular Weight: 300.28
Synonyms: ANTHRAQUINONE,3-METHOXY-6-METHYL-1,2,8-TRIHYDROXY;Anthraquinone,1,2,8-trihydroxy-3-methoxy-6-methyl;9,10-Anthracenedione,1,2,8-trihydroxy-3-methoxy-6-methyl;1,2,8-Trihydroxy-3-methoxy-6-methylanthraquinone;DERMOGLAUCIN;Dermoglancin;
Density: 1.542g/cm3
Melting Point: 236°C
Boiling Point: 559.8°Cat760mmHg
Flash Point: 213.5°C
Safety: Mutation data reported. When heated to decomposition it emits acrid smoke and irritating fumes.
PSA: 104.06000
LogP: 1.89580
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Chemistry

IUPAC Name: 1,2,8-trihydroxy-3-methoxy-6-methylanthracene-9,10-dione 
Empirical Formula: C16H12O6
Molecular Weight: 300.2629g/mol
Structure of 6-Methoxy-3-methyl-1,7,8-trihydroxy-9,10-anthraquinone (CAS NO.7213-59-4):

Index of Refraction: 1.707
Molar Refractivity: 75.81 cm3
Molar Volume: 194.6 cm3
Polarizability: 30.05×10-24cm3
Surface Tension: 77.4 dyne/cm
Density: 1.542 g/cm3
Flash Point: 213.5 °C
Enthalpy of Vaporization: 87.36 kJ/mol
Boiling Point: 559.8 °C at 760 mmHg
Vapour Pressure: 3.89E-13 mmHg at 25°C 
Classification Code: Mutation data 
Canonical SMILES: CC1=CC(=C2C(=C1)C(=O)C3=CC(=C(C(=C3C2=O)O)O)OC)O
InChI: InChI=1S/C16H12O6/c1-6-3-7-11(9(17)4-6)15(20)12-8(13(7)18)5-10(22-2)14(19)16(12)21/h3-5,17,19,21H,1-2H3
InChIKey: FRMFHVHHFVPACC-UHFFFAOYSA-N

Toxicity Data With Reference

1.    

mmo-sat 100 µg/plate

     BCSTB5    Biochemical Society Transactions. 5 (1977),1489.

Consensus Reports

EPA Genetic Toxicology Program.

Safety Profile

Mutation data reported. When heated to decomposition it emits acrid smoke and irritating fumes.

Specification

  6-Methoxy-3-methyl-1,7,8-trihydroxy-9,10-anthraquinone , its cas register number is 7213-59-4. It also can be called 
 1,2,8-Trihydroxy-3-methoxy-6-methylanthraquinone ; 9,10-Anthracenedione, 1,2,8-trihydroxy-3-methoxy-6-methyl- ;
 Anthraquinone, 1,2,8-trihydroxy-3-methoxy-6-methyl- ; BRN 2480118 ; DERMOGLAUCIN ; Dermoglancin ; NSC 257448 .