1-Hexadecen-3-ol,3,7,11,15-tetramethyl- (505-32-8)

The Isophytol with cas registry number of 505-32-8, belongs to the following product categories: (1)Biochemistry; (2)Terpenes; (3)Terpenes (Others); (4)Cnbio. It has the systematic name of 3,7,11,15-tetramethylhexadec-1-en-3-ol. And it is also named 1-Hexadecene-3-ol, 3,7,11,15-tetramethyl.

Physical properties about this chemical are: (1)ACD/LogP: 8.28; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 8.28; (4)ACD/LogD (pH 7.4): 8.28; (5)ACD/BCF (pH 5.5): 1000000; (6)ACD/BCF (pH 7.4): 1000000; (7)ACD/KOC (pH 5.5): 764997.19; (8)ACD/KOC (pH 7.4): 764997.19; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 14; (12)Polar Surface Area: 9.23 Å²; (13)Index of Refraction: 1.456; (14)Molar Refractivity: 95.8 cm³; (15)Molar Volume: 352.4 cm³; (16)Polarizability: 37.98×10^-24cm³; (17)Surface Tension: 29.4 dyne/cm; (18)Enthalpy of Vaporization: 66.07 kJ/mol; (19)Vapour Pressure: 1.49E-05 mmHg at 25°C.

 When you are using this chemical, please be cautious about it as the following:
The Isophytol irritates to eyes, respiratory system and skin. When use it, avoid contact with skin and eyes and wear suitable protective clothing, gloves and eye/face protection. If 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: OC(\C=C)(CCCC(CCCC(C)CCCC(C)C)C)C;
(2)InChI: InChI=1/C20H40O/c1-7-20(6,21)16-10-15-19(5)14-9-13-18(4)12-8-11-17(2)3/h7,17-19,21H,1,8-16H2,2-6H3;
(3)InChIKey: KEVYVLWNCKMXJX-UHFFFAOYAI;
(4)Std. InChI: InChI=1S/C20H40O/c1-7-20(6,21)16-10-15-19(5)14-9-13-18(4)12-8-11-17(2)3/h7,17-19,21H,1,8-16H2,2-6H3;
(5)Std. InChIKey: KEVYVLWNCKMXJX-UHFFFAOYSA-N