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The 3,5-Dibromobenzyl alcohol, with the CAS registry number 145691-59-4, is also known as 3,5-Dibromobenzyl alcohol. It belongs to the product categories of Benzhydrols, Benzyl & Special Alcohols; Alcohol; Alcohols; Bromine Compounds. This chemical's molecular formula is C7H6Br2O and molecular weight is 265.93. Its IUPAC name is called (3,5-dibromophenyl)methanol. The product should be sealed and stored in cool, dry and well-ventilated place.
Physical properties of 3,5-Dibromobenzyl alcohol: (1)ACD/LogP: 2.53; (2)ACD/LogD (pH 5.5): 2.53; (3)ACD/LogD (pH 7.4): 2.53; (4)ACD/BCF (pH 5.5): 49.41; (5)ACD/BCF (pH 7.4): 49.41; (6)ACD/KOC (pH 5.5): 567.63; (7)ACD/KOC (pH 7.4): 567.63; (8)#H bond acceptors: 1; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 2; (11)Index of Refraction: 1.627; (12)Molar Refractivity: 48.08 cm3; (13)Molar Volume: 135.6 cm3; (14)Surface Tension: 50.6 dyne/cm; (15)Density: 1.96 g/cm3; (16)Flash Point: 152.1 °C; (17)Enthalpy of Vaporization: 60.2 kJ/mol; (18)Boiling Point: 327.9 °C at 760 mmHg; (19)Vapour Pressure: 7.93E-05 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
This chemical may destroy living tissue on contact. It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you will contact it, please wear suitable protective clothing, gloves and eye/face protection.
You can still convert the following datas into molecular structure:
(1)SMILES: Brc1cc(cc(Br)c1)CO
(2)InChI: InChI=1/C7H6Br2O/c8-6-1-5(4-10)2-7(9)3-6/h1-3,10H,4H2
(3)InChIKey: ZQNSHKZQTZSNTB-UHFFFAOYAQ