Tricyclo[3.3.1.13,7]decane-1-aceticacid, 3-hydroxy-a-oxo- (709031-28-7)

The cas register number of 2-(3-Hydroxy-1-adamantyl)-2-oxoacetic acid is 709031-28-7. It also can be called as 3-Hydroxy-alpha-oxotricyclo[3.3.1.13,7]decane-1-acetic acid and the Systematic name about this chemical is (3-hydroxytricyclo[3.3.1.13,7]dec-1-yl)(oxo)acetic acid.

Physical properties about 2-(3-Hydroxy-1-adamantyl)-2-oxoacetic acid are: (1)ACD/LogP: -0.23; (2)ACD/LogD (pH 5.5): -3; (3)ACD/LogD (pH 7.4): -4; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 4; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 74.6 Å²; (12)Index of Refraction: 1.635; (13)Molar Refractivity: 54.384 cm³; (14)Molar Volume: 151.827 cm³; (15)Polarizability: 21.56x0^-24cm³; (16)Surface Tension: 80.666 dyne/cm; (17)Enthalpy of Vaporization: 70.936 kJ/mol; (18)Boiling Point: 366.525 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
SMILES: O=C(O)C(=O)C13CC2CC(CC(O)(C1)C2)C3
InChI: InChI=1/C12H16O4/c13-9(10(14)15)11-2-7-1-8(3-11)5-12(16,4-7)6-11/h7-8,16H,1-6H2,(H,14,15)
InChIKey: UDKIRRNUAXWHTO-UHFFFAOYAO
Std. InChI: InChI=1S/C12H16O4/c13-9(10(14)15)11-2-7-1-8(3-11)5-12(16,4-7)6-11/h7-8,16H,1-6H2,(H,14,15)
Std. InChIKey: UDKIRRNUAXWHTO-UHFFFAOYSA-N