Ethanone,1-[3-methoxy-4-(phenylmethoxy)phenyl]- (1835-11-6)

The 1-[4-(Benzyloxy)-3-methoxyphenyl]ethanone with the cas number 1835-11-6 is also called Ethanone,1-[3-methoxy-4-(phenylmethoxy)phenyl]-. The IUPAC name is 1-(3-methoxy-4-phenylmethoxyphenyl)ethanone. Its molecular formula is C₁₆H₁₆O₃. The product category is Aromatic Acetophenones & Derivatives (substituted).

The properties of the chemical are: (1)ACD/LogP: 3.48; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.48; (4)ACD/LogD (pH 7.4): 3.48; (5)ACD/BCF (pH 5.5): 258.57; (6)ACD/BCF (pH 7.4): 258.57; (7)ACD/KOC (pH 5.5): 1855.78; (8)ACD/KOC (pH 7.4): 1855.78; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 35.53 Å²; (13)Index of Refraction: 1.558; (14)Molar Refractivity: 74.12 cm³; (15)Molar Volume: 229.6 cm³; (16)Polarizability: 29.38×10^-24cm³; (17)Surface Tension: 40 dyne/cm; (18)Enthalpy of Vaporization: 64.68 kJ/mol; (19)Vapour Pressure: 1.7×10^-6 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(c2cc(OC)c(OCc1ccccc1)cc2)C
(2)InChI: InChI=1/C16H16O3/c1-12(17)14-8-9-15(16(10-14)18-2)19-11-13-6-4-3-5-7-13/h3-10H,11H2,1-2H3
(3)InChIKey: HRUAWSQBQLYDKH-UHFFFAOYAR

The toxicity data is as follows: