The 2-(3,5-Dimethoxyphenyl)propan-2-ol with the cas number 39507-96-5 is also called Benzenemethanol,3,5-dimethoxy-a,a-dimethyl-. Its EINECS registry number is 254-476-1. The molecular formula is C11H16O3. The product's category is Benzene derivates. This chemical is a kind of organics. It should be stored in dry and cool environment.
The properties of the chemical are: (1)ACD/LogP: 1.44; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.44; (4)ACD/LogD (pH 7.4): 1.44; (5)ACD/BCF (pH 5.5): 7.35; (6)ACD/BCF (pH 7.4): 7.35; (7)ACD/KOC (pH 5.5): 145.12; (8)ACD/KOC (pH 7.4): 145.12; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 27.69Å2; (13)Index of Refraction: 1.504; (14)Molar Refractivity: 54.89 cm3; (15)Molar Volume: 185.1 cm3; (16)Polarizability: 21.76×10-24cm3; (17)Surface Tension: 33.5 dyne/cm ; (18)Enthalpy of Vaporization: 57.82 kJ/mol; (19)Vapour Pressure: 0.000323 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O(c1cc(cc(OC)c1)C(O)(C)C)C
(2)InChI: InChI=1/C11H16O3/c1-11(2,12)8-5-9(13-3)7-10(6-8)14-4/h5-7,12H,1-4H3
(3)InChIKey: HJWIHSLWFROGED-UHFFFAOYAC
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