Allyl methyl carbonate

The cas register number of Allyl methyl carbonate is 35466-83-2. It also can be called as Carbonic acid, methyl 2-propenyl ester and the IUPAC Name about this chemical is methyl prop-2-enyl carbonate. It belongs to the following product categories, such as Aliphatics, Esters, Acyclic, Alkenes, Organic Building Blocks, Allyl Monomers, Monomers, Polymer Science and so on.

Physical properties about Allyl methyl carbonate are: (1)ACD/LogP: 0.98; (2)ACD/LogD (pH 5.5): 0.97; (3)ACD/LogD (pH 7.4): 0.97; (4)ACD/BCF (pH 5.5): 3.24; (5)ACD/BCF (pH 7.4): 3.24; (6)ACD/KOC (pH 5.5): 80.8; (7)ACD/KOC (pH 7.4): 80.8; (8)#H bond acceptors: 3; (9)#Freely Rotating Bonds: 4; (10)Polar Surface Area: 35.53Ų; (11)Index of Refraction: 1.405; (12)Molar Refractivity: 28.45 cm³; (13)Molar Volume: 116 cm³; (14)Polarizability: 11.28x10^-24cm³; (15)Surface Tension: 27 dyne/cm; (16)Enthalpy of Vaporization: 38.03 kJ/mol; (17)Vapour Pressure: 5.4 mmHg at 25°C.

Preparation: this chemical can be prepared by prop-2-en-1-ol and carbonochloridic acid methyl ester. This reaction will need reagent pyridine and solvent diethyl ether. The reaction time is 5 hour(s) with reaction temperature of 5 hour(s). The yield is about 86%.

Uses of Allyl methyl carbonate: it can be used to produce 2-allylsulfanyl-pyridine with 1H-pyridine-2-thione at temperature of 50 ℃. This reaction will need reagent Pd₂(dba)₃, 1,4-bis(diphenylphosphino)butane and solvent tetrahydrofuran with reaction time of 24 hours. The yield is about 86%.

When you are using this chemical, please be cautious about it as the following:
This chemical is flammable and it is irritating to eyes, respiratory system and skin. When you are using it, wear suitable protective clothing, gloves and eye/face protection, you also need keep away from sources of ignition. 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(=O)OCC=C
(2)InChI: InChI=1S/C5H8O3/c1-3-4-8-5(6)7-2/h3H,1,4H2,2H3
(3)InChIKey: YHLVIDQQTOMBGN-UHFFFAOYSA-N