Naphthalene,1,8-dibromo- (17135-74-9)

The IUPAC name of 1,8-Dibromonaphtalene is 1,8-dibromonaphthalene. With the CAS registry number 17135-74-9, it is also named as Naphthalene,1,8-dibromo-. Besides, it is off-white solid which should avoid contact with strong oxidizing agents. This chemical is mainly used for coupling reaction. In addition, its molecular formula is C₁₀H₆Br₂ and molecular weight is 285.96.

The other characteristics of 1,8-Dibromonaphtalene can be summarized as: (1)ACD/LogP: 4.99; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.99; (4)ACD/LogD (pH 7.4): 4.99; (5)ACD/BCF (pH 5.5): 3666.34; (6)ACD/BCF (pH 7.4): 3666.34; (7)ACD/KOC (pH 5.5): 12384.32; (8)ACD/KOC (pH 7.4): 12384.32; (9)H bond acceptors: 0; (10)H bond donors: 0; (11)Freely Rotating Bonds: 0; (12)Index of Refraction: 1.688; (13)Molar Refractivity: 59.47 cm³; (14)Molar Volume: 155.9 cm³; (15)Polarizability: 23.57×10^-24cm³; (16)Surface Tension: 48.7 dyne/cm; (17)Density: 1.834 g/cm³; (18)Flash Point: 184.7 °C; (19)Enthalpy of Vaporization: 55.95 kJ/mol; (20)Boiling Point: 339.1 °C at 760 mmHg; (21)Vapour Pressure: 0.000184 mmHg at 25 °C; (22)Melting Point: 106-108 °C.

People can use the following data to convert to the molecule structure.
(1)SMILES:Brc1cccc2cccc(Br)c12
(2)InChI:InChI=1/C10H6Br2/c11-8-5-1-3-7-4-2-6-9(12)10(7)8/h1-6H
(3)InChIKey:DLXBGTIGAIESIG-UHFFFAOYAQ
(4)Std. InChI:InChI=1S/C10H6Br2/c11-8-5-1-3-7-4-2-6-9(12)10(7)8/h1-6H
(5)Std. InChIKey:DLXBGTIGAIESIG-UHFFFAOYSA-N