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CAS No.: | 111439-76-0 |
---|---|
Name: | Isobutylisopropyldimethoxysilane |
Molecular Structure: | |
Formula: | C9H22O2Si |
Molecular Weight: | 190.36 |
Synonyms: | Dimethoxyisobutylisopropylsilane;Isobutylisopropyldimethoxysilane; |
EINECS: | 402-580-4 |
Density: | 0.871 g/cm3 |
Boiling Point: | 182.9 °C at 760 mmHg |
Flash Point: | 68.5 °C |
Solubility: | 18mg/L at 25℃ |
Appearance: | Colorless clear liquid. |
Hazard Symbols: | Xn |
Risk Codes: | 10-20/21/22-38-20 |
Safety: | 16-36/37/39-36/37-26-25 |
Transport Information: | 1993 |
PSA: | 18.46000 |
LogP: | 2.78740 |
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This chemical is called Isobutylisopropyldimethoxysilane, and it can also be named as silane, dimethoxy(1-methylethyl)(2-methylpropyl)-. With the molecular formula of C9H22O2Si, its molecular weight is 190.36. The CAS registry number of this chemical is 111439-76-0, and its product category is Silane Reagents.
Other characteristics of the Isobutylisopropyldimethoxysilane can be summarised as followings: (1)ACD/LogP: 1.84; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.84; (4)ACD/LogD (pH 7.4): 1.84; (5)ACD/BCF (pH 5.5): 14.64; (6)ACD/BCF (pH 7.4): 14.64; (7)ACD/KOC (pH 5.5): 237.61; (8)ACD/KOC (pH 7.4): 237.61; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 18.46 Å2; (13)Index of Refraction: 1.408; (14)Molar Refractivity: 55.86 cm3; (15)Molar Volume: 226.3 cm3; (16)Polarizability: 22.14×10-24cm3; (17)Surface Tension: 20.8 dyne/cm; (18)Density: 0.841 g/cm3; (19)Flash Point: 68.5 °C; (20)Enthalpy of Vaporization: 40.19 kJ/mol; (21)Boiling Point: 182.9 °C at 760 mmHg; (22)Vapour Pressure: 1.08 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following: This chemical is flammable. Keep away from sources of ignition. It's harmful by inhalation, in contacting with skin and if swallowed. Avoid contact with eyes. Wear suitable protective clothing, gloves and eye/face protection. 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(C)[Si](OC)(C(C)C)CC(C)C
2.InChI: InChI=1/C9H22O2Si/c1-8(2)7-12(10-5,11-6)9(3)4/h8-9H,7H2,1-6H3
3.InChIKey: XFAOZKNGVLIXLC-UHFFFAOYAF