2,6-DIISOPROPYLNAPHTHALENE

The Naphthalene,2,6-bis(1-methylethyl)-, with the CAS registry number 24157-81-1, is also known as 2,6-Diisopropylnaphthalene. It belongs to the product categories of Color Former & Related Compounds; Functional Materials; Sensitizer. Its EINECS registry number is 246-045-1. This chemical's molecular formula is C₁₆H₂₀ and molecular weight is 212.33. Its IUPAC name is called 2,6-di(propan-2-yl)naphthalene. When you are using this chemical, please be cautious about it. You must avoid contacting it with skin and eyes.

Physical properties of Naphthalene,2,6-bis(1-methylethyl)-: (1)ACD/LogP: 6.13; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 6.13; (4)ACD/LogD (pH 7.4): 6.13; (5)ACD/BCF (pH 5.5): 26682.89; (6)ACD/BCF (pH 7.4): 26682.89; (7)ACD/KOC (pH 5.5): 51272.23; (8)ACD/KOC (pH 7.4): 51272.23; (9)#Freely Rotating Bonds: 2; (10)Index of Refraction: 1.561; (11)Molar Refractivity: 72.46 cm³; (12)Molar Volume: 223.6 cm³; (13)Surface Tension: 34.2 dyne/cm; (14)Density: 0.949 g/cm³; (15)Flash Point: 142.5 °C; (16)Enthalpy of Vaporization: 52.45 kJ/mol; (17)Boiling Point: 305.8 °C at 760 mmHg; (18)Vapour Pressure: 0.00145 mmHg at 25°C.

Uses of Naphthalene,2,6-bis(1-methylethyl)-: it can be used to produce naphthalene-2,6-diol at temperature of 75 °C. This reaction will need reagent air-O₂, N-hydroxyphthalimide, a,a'-azobisisobutyronitrile, aq. H₂SO₄ and solvent acetonitrile with reaction time of 21 hours. The yield is about 92%.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC(C)C1=CC2=C(C=C1)C=C(C=C2)C(C)C
(2)InChI: InChI=1S/C16H20/c1-11(2)13-5-7-16-10-14(12(3)4)6-8-15(16)9-13/h5-12H,1-4H3
(3)InChIKey: GWLLTEXUIOFAFE-UHFFFAOYSA-N