Cyclopentane, methoxy- (5614-37-9)

The Cyclopentyl methyl ether, with the cas registry number 5614-37-9, has the IUPAC name of methoxycyclopentane. It is a kind of clear liquid. And the molecular formula of the chemical is C₆H₁₂O.

The characteristics of this chemical are as followings: (1)ACD/LogP: 1.41; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.41; (4)ACD/LogD (pH 7.4): 1.41; (5)ACD/BCF (pH 5.5): 6.99; (6)ACD/BCF (pH 7.4): 6.99; (7)ACD/KOC (pH 5.5): 140.01; (8)ACD/KOC (pH 7.4): 140.01; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 9.23 Å²; (13)Index of Refraction: 1.423; (14)Molar Refractivity: 29.49 cm³; (15)Molar Volume: 115.7 cm³; (16)Polarizability: 11.69×10^-24cm³; (17)Surface Tension: 25 dyne/cm; (18)Density: 0.86 g/cm³; (19)Flash Point: 6.5 °C; (20)Enthalpy of Vaporization: 33 kJ/mol; (21)Boiling Point: 105.3 °C at 760 mmHg; (22)Vapour Pressure: 34.6 mmHg at 25°C.

Preparation of Cyclopentyl methyl ether: This chemical can be prepared by phosphoric acid trimethyl ester and cyclopentanol. The reaction will need reagent PPA. The reaction time is 2 hours with the temperature 180-190°C, and the yield is about 63%. 

When you are using this chemical, please be cautious about it as the following: It is highly flammable and harmful if swallowed. What's more, it irritates to eyes and skin. Therefore, if in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: O(C)C1CCCC1
(2)InChI: InChI=1/C6H12O/c1-7-6-4-2-3-5-6/h6H,2-5H2,1H3
(3)InChIKey: SKTCDJAMAYNROS-UHFFFAOYAE