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Silane,chlorodimethyl(1,1,2-trimethylpropyl)-

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Silane,chlorodimethyl(1,1,2-trimethylpropyl)-

EINECS -0
CAS No. 67373-56-2 Density 0.858 g/cm3
PSA 0.00000 LogP 3.86650
Solubility N/A Melting Point 15 °C
Formula C8H19ClSi Boiling Point 171.3 °C at 760 mmHg
Molecular Weight 178.777 Flash Point 51.7 °C
Transport Information UN 2986 Appearance colorless liquid
Safety 26-36/37/39-45 Risk Codes 10-34-37
Molecular Structure Molecular Structure of 67373-56-2 (DIMETHYLTHEXYLSILYL CHLORIDE) Hazard Symbols CorrosiveC
Synonyms

Chlorodimethyl(1,1,2-trimethylpropyl)silane;Chlorodimethylthexylsilane;Dimethyl(1,1,2-trimethylpropyl)silyl chloride;Dimethylthexylsilyl chloride;Thexyldimethylchlorosilane;Thexyldimethylsilylchloride;Chloro(2,3-dimethylbutan-2-yl)dimethylsilane;

Article Data 7

Silane,chlorodimethyl(1,1,2-trimethylpropyl)- Specification

The Silane,chlorodimethyl(1,1,2-trimethylpropyl)-, with the CAS registry number 67373-56-2, is also known as Dimethylthexylsilyl chloride. This chemical's molecular formula is C8H19ClSi and formula weight is 178.775. What's more, its IUPAC name is chloro-(2,3-dimethylbutan-2-yl)-dimethylsilane. The product should be sealed and stored in containers with dry inert gas which are placed in cool and dry places. It should be protected from moisture and strong oxidizers.

Physical properties of Silane,chlorodimethyl(1,1,2-trimethylpropyl)- are: (1)ACD/LogP: 4.28; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.28; (4)ACD/BCF (pH 5.5): 1057.75; (5)ACD/KOC (pH 5.5): 5086.9; (6)#Freely Rotating Bonds: 2; (7)Index of Refraction: 1.419; (8)Molar Refractivity: 52.6 cm3; (9)Molar Volume: 208.1 cm3; (10)Surface Tension: 20 dyne/cm; (11)Density: 0.858 g/cm3; (12)Flash Point: 51.7 °C; (13)Enthalpy of Vaporization: 39.1 kJ/mol; (14)Boiling Point: 171.3 °C at 760 mmHg; (15)Vapour Pressure: 1.87 mmHg at 25°C.

Preparation: this chemical can be prepared by dimethyl-(1,1,2-trimethyl-propyl)-silanol. This reaction will need reagent SOCl2 and solvent CHCl3 with the reaction time of 30 min. The yield is about 82%.

Uses of Silane,chlorodimethyl(1,1,2-trimethylpropyl)-: it can be used to produce (dimethylthexylsilyloxy)methyl ethyl sulfide at the ambient temperature. It will need reagent 4-(dimethylamino)pyridine, Et3N and solvent CH2Cl2 with the reaction time of 6.5 hours. The yield is about 78%.

When you are using this chemical, please be cautious about it as the following:
It is flammable and is irritating to respiratory system. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. It can cause burns. When using it, you need wear suitable protective clothing, gloves and eye/face protection. In case of accident or if you feel unwell seek medical advice immediately (show the label where possible).

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC(C)C(C)(C)[Si](C)(C)Cl
(2)InChI: InChI=1S/C8H19ClSi/c1-7(2)8(3,4)10(5,6)9/h7H,1-6H3
(3)InChIKey: KIGALSBMRYYLFJ-UHFFFAOYSA-N

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