5-CYCLOHEXYL-1-PENTANOL

This chemical is called Cyclohexanemethanol, α-butyl-, and its systematic name is 1-cyclohexylpentan-1-ol. With the molecular formula of C₁₁H₂₂O, its molecular weight is 170.29. The CAS registry number of this chemical is 7338-43-4.

Other characteristics of the Cyclohexanemethanol, α-butyl- can be summarised as followings: (1)ACD/LogP: 3.81; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.81; (4)ACD/LogD (pH 7.4): 3.81; (5)ACD/BCF (pH 5.5): 465.9; (6)ACD/BCF (pH 7.4): 465.9; (7)ACD/KOC (pH 5.5): 2828.56; (8)ACD/KOC (pH 7.4): 2828.56; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 9.23 Å²; (13)Index of Refraction: 1.465; (14)Molar Refractivity: 52.33 cm³; (15)Molar Volume: 189 cm³; (16)Polarizability: 20.74×10^-24cm³; (17)Surface Tension: 33.2 dyne/cm; (18)Density: 0.9 g/cm³; (19)Flash Point: 107.9 °C; (20)Enthalpy of Vaporization: 55.8 kJ/mol; (21)Boiling Point: 243.2 °C at 760 mmHg; (22)Vapour Pressure: 0.00552 mmHg at 25°C.

Production method of this chemical: The Cyclohexanemethanol, α-butyl- could be obtained by the reactant of 4-(1-cyclohexyl-pentyloxymethyl)-1,2-dimethoxy-benzene. This reaction needs the reagents of 9,10-dicyanoanthracene, anthraquinone, Mg(ClO₄)₂, and the solvents of acetonitrile, H₂O. The yield is 77 %. In addition, this reaction should be taken for 3 hours. The other condition is irradiation.

When you are using this chemical, please be cautious about it as the following: This chemical is irritating to eyes, respiratory system and skin. You should wear suitable protective clothing when you use it. In case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure: 
1.SMILES: OC(CCCC)C1CCCCC1
2.InChI: InChI=1/C11H22O/c1-2-3-9-11(12)10-7-5-4-6-8-10/h10-12H,2-9H2,1H3
3.InChIKey: PKXSPCMDZCKLCI-UHFFFAOYAV