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2550-04-1

Basic Information
CAS No.: 2550-04-1
Name: ALLYLTRIETHOXYSILANE
Article Data: 19
Molecular Structure:
Molecular Structure of 2550-04-1 (ALLYLTRIETHOXYSILANE)
Formula: C9H20O3Si
Molecular Weight: 204.341
Synonyms: Silane,allyltriethoxy- (6CI,7CI,8CI);Silane, triethoxy-2-propenyl- (9CI);2-Propenyltriethoxysilane;3-(Triethoxysilyl)propene;A 0564;A 0564 (couplingagent);Allyltriethoxysilane;LS 2920;NSC 89735;Triethoxyallylsilane;
EINECS: 219-843-2
Density: 0.9 g/cm3
Boiling Point: 181.5 °C at 760 mmHg
Flash Point: 21.1 °C
Solubility: Hydrolyzes in water.
Appearance: Clear to straw liquid
Hazard Symbols: IrritantXi
Risk Codes: 10-36/37/38
Safety: 26
PSA: 27.69000
LogP: 2.22080
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Specification

This chemical is called Silane, triethoxy-2-propen-1-yl-, and its CAS registry number is 2550-04-1. With the molecular formula of C9H20O3Si, its molecular weight is 204.34. Additionally, its product categories are Vinyl Silanes (Silane Coupling Agents); Functional Materials; Si (Classes of Silicon Compounds); Silane Coupling Agents; Si-O Compounds; Trialkoxysilanes; Vinylsilanes, Allylsilanes; Alkoxy Silanes; Organosilicon; Self Assembly & Contact Printing; Self-Assembly Materials; Silanes Organometallic Reagents.   

Other characteristics of the Silane, triethoxy-2-propen-1-yl- can be summarised as followings: (1)ACD/LogP: 2.56; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.56; (4)ACD/LogD (pH 7.4): 2.56; (5)ACD/BCF (pH 5.5): 51.78; (6)ACD/BCF (pH 7.4): 51.78; (7)ACD/KOC (pH 5.5): 586.95; (8)ACD/KOC (pH 7.4): 586.95; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 8; (12)Polar Surface Area: 27.69 Å2; (13)Index of Refraction: 1.419; (14)Molar Refractivity: 57.42 cm3; (15)Molar Volume: 227 cm3; (16)Polarizability: 22.76×10-24cm3; (17)Surface Tension: 23 dyne/cm; (18)Density: 0.9 g/cm3; (19)Flash Point: 21.1 °C; (20)Enthalpy of Vaporization: 40.07 kJ/mol; (21)Boiling Point: 181.5 °C at 760 mmHg; (22)Vapour Pressure: 1.15 mmHg at 25°C.

Uses of this chemical: The Silane, triethoxy-2-propen-1-yl- could react with triethoxysilane, and obtain the 1,3-bis(triethoxysilyl)propane. This reaction needs the reagent of chloroplatinic acid, and the solvent of benzene. The yield is 58 %. In addition, this reaction should be taken for 24 hours.

When you are using this chemical, please be cautious about it as the following: This chemical is flammable and it's irritating to eyes, respiratory system and skin. You should wear suitable protective clothing if you use it. In case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
1.SMILES: O(CC)[Si](OCC)(OCC)C\C=C
2.InChI: InChI=1/C9H20O3Si/c1-5-9-13(10-6-2,11-7-3)12-8-4/h5H,1,6-9H2,2-4H3
3.InChIKey: UMFJXASDGBJDEB-UHFFFAOYAT