Propanenitrile,3,3-dimethoxy- (57597-62-3)

The cas register number of 3,3-Dimethoxypropanenitrile is 57597-62-3. It also can be called as Propanenitrile,3,3-dimethoxy- and the IUPAC Name about this chemical is 3,3-dimethoxypropanenitrile. It belongs to the following product categories, such as API intermediates, C1 to C5, Cyanides/Nitriles, Nitrogen Compounds and so on.

Physical properties about 3,3-Dimethoxypropanenitrile are: (1)ACD/LogP: 0.04; (2)ACD/LogD (pH 5.5): 0.04; (3)ACD/LogD (pH 7.4): 0.04; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 25.11; (7)ACD/KOC (pH 7.4): 25.11; (8)#H bond acceptors: 3; (9)#Freely Rotating Bonds: 3; (10)Polar Surface Area: 42.25Ų; (11)Index of Refraction: 1.401; (12)Molar Refractivity: 28.57 cm³; (13)Molar Volume: 117.5 cm³; (14)Polarizability: 11.32x10^-24cm³; (15)Surface Tension: 30.4 dyne/cm; (16)Enthalpy of Vaporization: 42.34 kJ/mol; (17)Vapour Pressure: 0.639 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical is harmful by inhalation, in contact with skin and if swallowed. When you are using it, wear suitable gloves and eye/face protection, and also not breathe vapour. After contact with skin, wash immediately with plenty of soap-suds. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: COC(CC#N)OC
(2)InChI: InChI=1S/C5H9NO2/c1-7-5(8-2)3-4-6/h5H,3H2,1-2H3
(3)InChIKey: JYHSJQNYYLGMEI-UHFFFAOYSA-N