The 9,10-Anthracenedione,1,2,7-trihydroxy-, with the CAS registry number 602-65-3, is also known as 1,2,7-Trihydroxyanthraquinone. This chemical's molecular formula is C14H8O5 and molecular weight is 256.21. What's more, its systematic name is 1,2,7-Trihydroxyanthracene-9,10-dione. The product is stable at common pressure and temperature, and it should be sealed and stored in containers which are placed in dry places.
Physical properties of 9,10-Anthracenedione,1,2,7-trihydroxy- are: (1)ACD/LogP: 4.08; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.01; (4)ACD/LogD (pH 7.4): 2.48; (5)#H bond acceptors: 5; (6)#H bond donors: 3; (7)#Freely Rotating Bonds: 3; (8)Polar Surface Area: 94.83 Å2; (9)Index of Refraction: 1.772; (10)Molar Refractivity: 64.31 cm3; (11)Molar Volume: 154.3 cm3; (12)Polarizability: 25.49×10-24 cm3; (13)Surface Tension: 93.9 dyne/cm; (14)Density: 1.659 g/cm3; (15)Flash Point: 247.3 °C; (16)Enthalpy of Vaporization: 75.06 kJ/mol; (17)Boiling Point: 462 °C at 760 mmHg; (18)Vapour Pressure: 3.72E-09 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
It is irritating to eyes, respiratory system and skin. When using it, you can't breathe dust and you should also avoid contact with skin and eyes.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC2=C(C=C1O)C(=O)C3=C(C2=O)C=CC(=C3O)O
(2)InChI: InChI=1S/C14H8O5/c15-6-1-2-7-9(5-6)13(18)11-8(12(7)17)3-4-10(16)14(11)19/h1-5,15-16,19H
(3)InChIKey: WNHUAWNEKMITEW-UHFFFAOYSA-N
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