4,6-Dioxatricyclo[3.3.1.02,7]nonane,1,3,3-trimethyl-, (1R,2S,5R,7R)- (65035-34-9)

 The Lineatin with cas registry number of 65035-34-9,  is also called 4,6-Dioxatricyclo[3.3.1.02,7]nonane,1,3,3-trimethyl-, (1R)- ; (+)-Lineatin ; (+/-)-3,3,7-Trimethyl-2,9-dioxatricyclo[3.3.1.04,7]nonane ; (1R,2α,5R)-3,3,7α-Trimethyl-4,9-dioxatricyclo[3.3.1.02,7]nonane .

Physical properties of  Lineatin : (1)ACD/LogP: 1.62; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1; (4)ACD/LogD (pH 7.4): 1; (5)ACD/BCF (pH 5.5): 6; (6)ACD/BCF (pH 7.4): 6; (7)ACD/KOC (pH 5.5): 128; (8)ACD/KOC (pH 7.4): 128; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 18.46 Å²; (13)Index of Refraction: 1.492; (14)Molar Refractivity: 45.528 cm³; (15)Molar Volume: 156.961 cm³; (16)Polarizability: 18.049×10^-24cm³; (17)Surface Tension: 39.075 dyne/cm; (18)Enthalpy of Vaporization: 42.039 kJ/mol; (19)Vapour Pressure: 0.423 mmHg at 25°C .

You can still convert the following datas into molecular structure: (1)SMILES:CC2(C)O[C@@H]1C[C@@]3(C)C[C@@H](O1)[C@@H]23; (2)InChI:InChI=1/C10H16O2/c1-9(2)8-6-4-10(8,3)5-7(11-6)12-9/h6-8H,4-5H2,1-3H3/t6-,7-,8+,10-/m1/s1; (3)InChIKey:SHTFZHTWSLHVEB-BDNRQGISBU; (4)Std. InChI:InChI=1S/C10H16O2/c1-9(2)8-6-4-10(8,3)5-7(11-6)12-9/h6-8H,4-5H2,1-3H3/t6-,7-,8+,10-/m1/s1; (5)Std. InChIKey:SHTFZHTWSLHVEB-BDNRQGISSA-N.