6-PHENYL-1-HEXANOL

The Benzenehexanol is an organic compound with the formula C₁₂H₁₈O. The IUPAC name of this chemical is 6-phenylhexan-1-ol. With the CAS registry number 2430-16-2, it is also named as 6-Phenyl-1-hexanol. The product's categories are Aromatics Compounds; Aromatics. Besides, it should be stored in a closed cool and dry place.

Physical properties about Benzenehexanol are: (1)ACD/LogP: 3.33; (2)ACD/LogD (pH 5.5): 3.33; (3)ACD/LogD (pH 7.4): 3.33; (4)ACD/BCF (pH 5.5): 199.7; (5)ACD/BCF (pH 7.4): 199.7; (6)ACD/KOC (pH 5.5): 1542.47; (7)ACD/KOC (pH 7.4): 1542.47; (8)#H bond acceptors: 1; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 7; (11)Polar Surface Area: 9.23 Å²; (12)Index of Refraction: 1.513; (13)Molar Refractivity: 55.86 cm³; (14)Molar Volume: 185.7 cm³; (15)Polarizability: 22.14×10^-24cm³; (16)Surface Tension: 37.4 dyne/cm; (17)Density: 0.959 g/cm³; (18)Flash Point: 121.8 °C; (19)Enthalpy of Vaporization: 55.32 kJ/mol; (20)Boiling Point: 284.8 °C at 760 mmHg; (21)Vapour Pressure: 0.00137 mmHg at 25°C.

Preparation: this chemical can be prepared by 6-phenyl-hexanoic acid methyl ester. This reaction will need reagent DIBAL-H and solvents tetrahydrofuran, toluene. The reaction time is 120 min with reaction temperature of 0 °C. The yield is about 76%.

Uses of Benzenehexanol: it can be used to produce (6-bromo-hexyl)-benzene. It will need reagents sulfuric acid, red phosphorus, aqueous hydrobromic acid.

When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin. When you are using it, wear suitable gloves and eye/face protection. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: OCCCCCCc1ccccc1
(2)InChI: InChI=1/C12H18O/c13-11-7-2-1-4-8-12-9-5-3-6-10-12/h3,5-6,9-10,13H,1-2,4,7-8,11H2
(3)InChIKey: FDXBUMXUJRZANT-UHFFFAOYAH
(4)Std. InChI: InChI=1S/C12H18O/c13-11-7-2-1-4-8-12-9-5-3-6-10-12/h3,5-6,9-10,13H,1-2,4,7-8,11H2
(5)Std. InChIKey: FDXBUMXUJRZANT-UHFFFAOYSA-N