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2-(Trimethylsilyloxy)propene

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Name

2-(Trimethylsilyloxy)propene

EINECS 217-393-1
CAS No. 1833-53-0 Density 0.792 g/cm3
PSA 9.23000 LogP 2.37150
Solubility Sparingly soluble in water Melting Point 40-45 °C
Formula C6H14OSi Boiling Point 92.951 °C at 760 mmHg
Molecular Weight 130.262 Flash Point 7.222 °C
Transport Information UN 1993 3/PG 2 Appearance clear colorless liquid
Safety 16-26-36-37/39 Risk Codes 11-36/37/38
Molecular Structure Molecular Structure of 1833-53-0 (ISOPROPENYLOXYTRIMETHYLSILANE) Hazard Symbols FlammableF; IrritantXi
Synonyms

Silane,(isopropenyloxy)trimethyl- (7CI,8CI);(Isopropenyloxy)trimethylsilane;2-(Trimethylsiloxy)propene;2-(Trimethylsilyloxy)-1-propene;2-(Trimethylsilyloxy)propene;2-Trimethylsiloxy-1-propene;Acetonetrimethylsilyl enol ether;Isopropenyl trimethylsilyl ether;Trimethyl(prop-1-en-2-yloxy)silane;Trimethyl[(1-methylethenyl)oxy]silane;Trimethyl[(1-methylvinyl)oxy]silane;

Article Data 36

2-(Trimethylsilyloxy)propene Specification

The 2-(Trimethylsilyloxy)propene, with CAS registry number 1833-53-0, belongs to the following product categories: (1)Monoalkoxysilanes; (2)Si (Classes of Silicon Compounds); (3)Silicon Compounds (for Synthesis); (4)Si-O Compounds; (5)Synthetic Organic Chemistry; (6)Vinylsilanes, Allylsilanes. It has the systematic name of trimethyl(prop-1-en-2-yloxy)silane. This chemical is a kind of clear colorless liquid. And it should be stored at the temperature of −20°C.

Physical properties of 2-(Trimethylsilyloxy)propene: (1)ACD/LogP: 2.12; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.122; (4)ACD/LogD (pH 7.4): 2.122; (5)ACD/BCF (pH 5.5): 24.147; (6)ACD/BCF (pH 7.4): 24.147; (7)ACD/KOC (pH 5.5): 339.998; (8)ACD/KOC (pH 7.4): 339.998; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 9.23 Å2; (13)Index of Refraction: 1.4; (14)Molar Refractivity: 39.877 cm3; (15)Molar Volume: 164.57 cm3; (16)Polarizability: 15.808×10-24cm3; (17)Surface Tension: 17.145 dyne/cm; (18)Enthalpy of Vaporization: 31.896 kJ/mol; (19)Vapour Pressure: 57.372 mmHg at 25°C.

Preparation: this chemical can be prepared by propan-2-one and chloro-trimethyl-silane. This reaction will need reagent Et3N.

When you are using this chemical, please be cautious about it as the following:
The 2-(Trimethylsilyloxy)propene irritates to eyes, respiratory system and skin. And this chemical is flammable, so keep it away from sources of ignition. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: CC(=C)O[Si](C)(C)C
(2)InChI: InChI=1/C6H14OSi/c1-6(2)7-8(3,4)5/h1H2,2-5H3
(3)InChIKey: UAIFZYSPVVBOPN-UHFFFAOYAZ
(4)Std. InChI: InChI=1S/C6H14OSi/c1-6(2)7-8(3,4)5/h1H2,2-5H3
(5)Std. InChIKey: UAIFZYSPVVBOPN-UHFFFAOYSA-N

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