9,10-Anthracenedione,2,3,6,7-tetramethoxy- supplier

Name
2,3,6,7-TETRAMETHOXYANTHRAQUINONE
EINECS
CAS No. 5629-55-0
Article Data1
CAS DataBase
Density 1.287 g/cm³
Solubility
Melting Point
Formula C₁₈H₁₆O₆
Boiling Point 523.4 ºC at 760 mmHg
Molecular Weight 328.321
Flash Point 232.7 ºC
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols Xi
Synonyms Anthraquinone,2,3,6,7-tetramethoxy- (6CI,7CI,8CI);2,3,6,7-Tetramethoxy-9,10-anthraquinone;2,3,6,7-Tetramethoxyanthraquinone;2,3,6,7-Tetramethoxyanthracene-9,10-dione;
PSA 71.06000
LogP 2.49640

9,10-Anthracenedione,2,3,6,7-tetramethoxy- Specification

The 9,10-Anthracenedione,2,3,6,7-tetramethoxy-, with the CAS registry number 5629-55-0, is also known as 2,3,6,7-Tetramethoxyanthraquinone. This chemical's molecular formula is C₁₈H₁₆O₆ and molecular weight is 328.32. What's more, its systematic name is 2,3,6,7-Tetramethoxyanthracene-9,10-dione.

Physical properties of 9,10-Anthracenedione,2,3,6,7-tetramethoxy- are: (1)ACD/LogP: 3.40; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.4; (4)ACD/LogD (pH 7.4): 3.4; (5)#H bond acceptors: 6; (6)#H bond donors: 0; (7)#Freely Rotating Bonds: 4; (8)Polar Surface Area: 71.06 Å²; (9)Index of Refraction: 1.584; (10)Molar Refractivity: 85.38 cm³; (11)Molar Volume: 255 cm³; (12)Polarizability: 33.84×10^-24cm³; (13)Surface Tension: 47.4 dyne/cm; (14)Density: 1.287 g/cm³; (15)Flash Point: 232.7 °C; (16)Enthalpy of Vaporization: 79.71 kJ/mol; (17)Boiling Point: 523.4 °C at 760 mmHg; (18)Vapour Pressure: 4.74E-11 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: COc2cc3C(=O)c1cc(OC)c(cc1C(=O)c3cc2OC)OC
(2)InChI: InChI=1S/C18H16O6/c1-21-13-5-9-10(6-14(13)22-2)18(20)12-8-16(24-4)15(23-3)7-11(12)17(9)19/h5-8H,1-4H3
(3)InChIKey: WAKICGWWAOUTLO-UHFFFAOYSA-N

Product Name

2,3,6,7-TETRAMETHOXYANTHRAQUINONE

9,10-Anthracenedione,2,3,6,7-tetramethoxy- Specification

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