Benzene,1,2,3,4,5,6-hexamethyl- (87-85-4)

The IUPAC name of Hexamethylbenzene is 1,2,3,4,5,6-Hexamethylbenzene . With the CAS registry number 87-85-4, it is also can be called as AI3-03275 ; EINECS 201-777-0 ; Mellitene ; NSC 3838 ; Benzene, 1,2,3,4,5,6-hexamethyl- ; Benzene, hexamethyl- . It is is white to light yellow crystalline powder. Hexamethylbenzene belongs to the product categories: Highly Purified Reagents;Other Categories;Zone Refined Products;Arenes;Building Blocks;Organic Building Blocks.

Properties of Hexamethylbenzene : (1)H bond acceptors: 0 ; (2)H bond donors: 0 ; (3)Freely Rotating Bonds: 0 ; (4)Index of Refraction: 1.501; (5)Heavy Atom Count: 12 ; (6)Formal Charge: 0 ; (7)Complexity: 91.6 ; (8)Isotope Atom Count: 0 ; (9)Defined Atom StereoCenter Count: 0 ; (10)Undefined Atom StereoCenter Count: 0 ; (11)Defined Bond StereoCenter Count: 0 ; (12)Undefined Bond StereoCenter Count: 0 ; (13)Covalently-Bonded Unit Count: 1 ; (14)Molar Refractivity: 55.2 cm3 ; (15)Molar Volume: 187 cm3 ; (16)Surface Tension: 28.7 dyne/cm ; (17)Enthalpy of Vaporization: 47.41 kJ/mol ; (18)Boiling Point: 256.6°C at 760 mmHg ; (19)Vapour Pressure: 0.0245 mmHg at 25°C

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC1=C(C(=C(C(=C1C)C)C)C)C;
(2)InChI: InChI=1S/C12H18/c1-7-8(2)10(4)12(6)11(5)9(7)3/h1-6H3 ;
(3)InChIKey: YUWFEBAXEOLKSG-UHFFFAOYSA-N

Toxicity data of Hexamethylbenzene is as following:

Reported in EPA TSCA Inventory.