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Trimethoxy(2,4,4-trimethylpentyl)silane

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Name

Trimethoxy(2,4,4-trimethylpentyl)silane

EINECS 251-995-5
CAS No. 34396-03-7 Density 0.883 g/cm3
PSA 27.69000 LogP 2.93680
Solubility 110-1000000mg/L at 20℃ Melting Point <0°C
Formula C11H26O3Si Boiling Point 181.781 °C at 760 mmHg
Molecular Weight 234.41 Flash Point 71.886 °C
Transport Information N/A Appearance N/A
Safety 9-16-26-36/37/39 Risk Codes 10-52/53
Molecular Structure Molecular Structure of 34396-03-7 (ISOOCTYLTRIMETHOXYSILANE) Hazard Symbols N/A
Synonyms

(2,4,4-Trimethylpentyl)trimethoxysilane;Isooctyltrimethoxysilane;

 

Trimethoxy(2,4,4-trimethylpentyl)silane Specification

The Silane, trimethoxy(2, 4, 4-trimethylpentyl)-, with the CAS registry number of 34396-03-7, is also known as Trimethoxy(2, 4, 4-trimethylpentyl)-silan and Isooctyltrimethoxysilane. Its EINECS registry number is 251-995-5. This chemical's molecular formula is C11H26O3Si and molecular weight is 234.41. What's more, its IUPAC name is Trimethoxy(2, 4, 4-trimethylpentyl)silane. This chemical's classification code is TSCA Flag P [A commenced PMN (Premanufacture Notice) substance].

Physical properties about Silane, trimethoxy(2, 4, 4-trimethylpentyl)- are: (1)ACD/LogP: 3.31; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.31; (4)ACD/LogD (pH 7.4): 3.31; (5)ACD/BCF (pH 5.5): 191.69; (6)ACD/BCF (pH 7.4): 191.69; (7)ACD/KOC (pH 5.5): 1497.92; (8)ACD/KOC (pH 7.4): 1497.92; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 7; (12)Polar Surface Area: 27.69 Å2; (13)Index of Refraction: 1.418; (14)Molar Refractivity: 66.88 cm3; (15)Molar Volume: 265.3 cm3; (16)Surface Tension: 22.8 dyne/cm; (17)Density: 0.883 g/cm3; (18)Flash Point: 71.9 °C; (19)Enthalpy of Vaporization: 40.09 kJ/mol; (20)Boiling Point: 181.8 °C at 760 mmHg; (21)Vapour Pressure: 1.14 mmHg at 25 °C.

When you are using this chemical, please be cautious about it as the following:
This chemical is harmful to aquatic organisms, may cause long-term adverse effects in the aquatic environment. In addition, this chemical is flammable, and it may catch fire in contact with an ignition source. Hence, keep it away from sources of ignition. During using it, wear suitable protective clothing, gloves and eye/face protection. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. Besides, keep container in a well-ventilated place.

You can still convert the following datas into molecular structure:
(1) SMILES: O(C)[Si](OC)(OC)CC(C)CC(C)(C)C
(2) InChI: InChI=1/C11H26O3Si/c1-10(8-11(2,3)4)9-15(12-5,13-6)14-7/h10H,8-9H2,1-7H3
(3) InChIKey: UWSYCPWEBZRZNJ-UHFFFAOYAS

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