Name: 2-(3-Cyclohexenyl)ethyltrimethoxysilane
SKU: 67592-36-3

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Basic Information

Molecular Structure:
CAS No.:	67592-36-3
Name:	2-(3-Cyclohexenyl)ethyltrimethoxysilane
Article Data:	2

Formula:	C₁₁H₂₂O₃Si
Molecular Weight:	230.379
Synonyms:	2-(1-cyclohex-3-enyl)ethyl-trimethoxy-silane;(2-(3-Cyclohexen-1-yl)ethyl)trimethoxysilane;(2-(3-Cyclohexenyl)ethyl)trimethoxysilane;Silane, (2-(3-cyclohexen-1-yl)ethyl)trimethoxy-;Cyclohexene, 4-[2-(trimethoxysilyl)ethyl]-;
EINECS:	266-749-2
Density:	0.953 g/cm³
Melting Point:	<0 ºC
Boiling Point:	240 °C at 760 mmHg
Flash Point:	98.1 °C
Risk Codes:	37/38
Safety:	26-36/37/39
PSA:	27.69000
LogP:	2.61090

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Specification

The 2-(3-Cyclohexenyl)ethyltrimethoxysilane, with the CAS registry number 67592-36-3, is also known as 2-(1-cyclohex-3-enyl)ethyl-trimethoxy-silane. Its EINECS number is 266-749-2. This chemical's molecular formula is C₁₁H₂₂O₃Si and formula weight is 230.38. What's more, its IUPAC name is 2-cyclohex-3-en-1-ylethyl(trimethoxy)silane.

Physical properties of 2-(3-Cyclohexenyl)ethyltrimethoxysilane are: (1)ACD/LogP: 2.81; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.81; (4)ACD/BCF (pH 5.5): 79.94; (5)ACD/KOC (pH 5.5): 800.99; (6)#H bond acceptors: 3; (7)#H bond donors: 0; (8)#Freely Rotating Bonds: 6; (9)Polar Surface Area: 27.69 Å²; (10)Index of Refraction: 1.446; (11)Molar Refractivity: 64.45 cm³; (12)Molar Volume: 241.6 cm³; (13)Surface Tension: 27.4 dyne/cm; (14)Density: 0.953 g/cm³; (15)Flash Point: 98.1 °C; (16)Enthalpy of Vaporization: 45.76 kJ/mol; (17)Boiling Point: 240 °C at 760 mmHg; (18)Vapour Pressure: 0.0601 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
It is irritating to respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. When using it, you need wear suitable protective clothing, gloves and eye/face protection.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CO[Si](CCC1CCC=CC1)(OC)OC
(2)InChI: InChI=1S/C11H22O3Si/c1-12-15(13-2,14-3)10-9-11-7-5-4-6-8-11/h4-5,11H,6-10H2,1-3H3
(3)InChIKey: LJNFZEBTNPLCMG-UHFFFAOYSA-N