DIETHYL DIALLYLMALONATE

The Propanedioic acid,2,2-di-2-propen-1-yl-, 1,3-diethyl ester, with the CAS registry number 3195-24-2, is also known as Diallylmalonic acid diethyl ester. It belongs to the product categories of Monomer; Aliphatics; Esters; C12 to C63; Carbonyl Compounds. Its EINECS registry number is 221-696-4. This chemical's molecular formula is C₁₃H₂₀O₄ and molecular weight is 240.2955. Its IUPAC name is called diethyl 2,2-bis(prop-2-enyl)propanedioate. What's more, the product should be sealed and stored in cool and dry place.

Physical properties of Propanedioic acid,2,2-di-2-propen-1-yl-, 1,3-diethyl ester: (1)ACD/LogP: 2.80; (2)ACD/LogD (pH 5.5): 2.799; (3)ACD/LogD (pH 7.4): 2.799; (4)ACD/BCF (pH 5.5): 78.88; (5)ACD/BCF (pH 7.4): 78.88; (6)ACD/KOC (pH 5.5): 793.343; (7)ACD/KOC (pH 7.4): 793.343; (8)#H bond acceptors: 4; (9)#Freely Rotating Bonds: 10; (10)Index of Refraction: 1.455; (11)Molar Refractivity: 65.242 cm³; (12)Molar Volume: 240.323 cm³; (13)Surface Tension: 32.074 dyne/cm; (14)Density: 1 g/cm³; (15)Flash Point: 106.728 °C; (16)Enthalpy of Vaporization: 48.052 kJ/mol; (17)Boiling Point: 243.499 °C at 760 mmHg; (18)Vapour Pressure: 0.032 mmHg at 25°C.

Preparation of Propanedioic acid,2,2-di-2-propen-1-yl-, 1,3-diethyl ester: this chemical can be prepared by malonic acid diethyl ester and 3-bromo-propene. This reaction will need reagent NaH.

Uses of Propanedioic acid,2,2-di-2-propen-1-yl-, 1,3-diethyl ester: it can be used to produce 2-allyl-pent-4-enoic acid ethyl ester at temperature of 160 °C. This reaction will need reagent NaCN and solvent dimethylsulfoxide.

When you are using this chemical, please be cautious about it as the following:
This chemical may cause inflammation to the skin or other mucous membranes. It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you will contact it, please wear suitable protective gloves and eye/face protection.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CCOC(=O)C(CC=C)(CC=C)C(=O)OCC
(2)InChI: InChI=1S/C13H20O4/c1-5-9-13(10-6-2,11(14)16-7-3)12(15)17-8-4/h5-6H,1-2,7-10H2,3-4H3
(3)InChIKey: LYUUVYQGUMRKOV-UHFFFAOYSA-N