Cyclopentylmethyl decanoate (120-19-4)

The Cyclopentylmethyl decanoate with the CAS number 120-19-4 is also called decanoic acid, cyclopentylmethyl ester. Its molecular formula is C₁₆H₃₀O₂. This chemical is a kind of esters. It should be stored in dry and cool environment.

The properties of the chemical are: (1)ACD/LogP: 6.45; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 6.45; (4)ACD/LogD (pH 7.4): 6.45; (5)ACD/BCF (pH 5.5): 47356.78; (6)ACD/BCF (pH 7.4): 47356.78; (7)ACD/KOC (pH 5.5): 77307.35; (8)ACD/KOC (pH 7.4): 77307.35; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 11; (12)Polar Surface Area: 26.3 Å²; (13)Index of Refraction: 1.457; (14)Molar Refractivity: 75.85 cm³; (15)Molar Volume: 278.3 cm³; (16)Polarizability: 30.07×10^-24cm³; (17)Surface Tension: 33 dyne/cm; (18)Enthalpy of Vaporization: 55.15 kJ/mol; (19)Vapour Pressure: 0.000593 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OCC1CCCC1)CCCCCCCCC
(2)InChI: InChI=1/C16H30O2/c1-2-3-4-5-6-7-8-13-16(17)18-14-15-11-9-10-12-15/h15H,2-14H2,1H3
(3)InChIKey: ACRFCWGJALRWRL-UHFFFAOYAU