CAS No.59414-23-2,1-METHOXY-3-TRIMETHYLSILOXY-1,3-BUTADIENE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	59414-23-2
Name:	1-METHOXY-3-TRIMETHYLSILOXY-1,3-BUTADIENE
Article Data:	3

Formula:	C₈H₁₆O₂Si
Molecular Weight:	172.299
Synonyms:	1-Methoxy-3-(trimethylsiloxy)butadiene;
EINECS:	261-753-0
Density:	0.872 g/cm³
Boiling Point:	181.7 °C at 760 mmHg
Flash Point:	45 °C
Appearance:	CLEAR LIGHT YELLOW TO BROWN LIQUID
Hazard Symbols:	R10:Flammable.;
Risk Codes:	10
Safety:	23-24/25
PSA:	18.46000
LogP:	2.51170

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Specification

The 1-Methoxy-3-(trimethylsiloxy)-1,3-butadiene, with the CAS registry number 59414-23-2, is also known as 1-Methoxy-3-(trimethylsiloxy)butadiene. This chemical's molecular formula is C₈H₁₆O₂Si and molecular weight is 172.2969. What's more, its systematic name is called [(4-Methoxybuta-1,3-dien-2-yl)oxy](trimethyl)silane.

Physical properties about 1-Methoxy-3-(trimethylsiloxy)-1,3-butadiene are: (1)ACD/LogP: 1.98; (2)#of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.98; (4)ACD/LogD (pH 7.4): 1.98; (5)ACD/BCF (pH 5.5): 18.95; (6)ACD/BCF (pH 7.4): 18.95; (7)ACD/KOC (pH 5.5): 285.88; (8)ACD/KOC (pH 7.4): 285.88; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 18.46 Å²; (13)Index of Refraction: 1.429; (14)Molar Refractivity: 50.94 cm³; (15)Molar Volume: 197.5 cm³; (16)Polarizability: 20.19×10^-24 cm³; (17)Surface Tension: 20.6 dyne/cm; (18)Density: 0.872 g/cm³; (19)Flash Point: 45 °C; (20)Enthalpy of Vaporization: 40.08 kJ/mol; (21)Boiling Point: 181.7 °C at 760 mmHg; (22)Vapour Pressure: 1.14 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O(/C(C=COC)=C)[Si](C)(C)C
(2) InChI: InChI=1/C8H16O2Si/c1-8(6-7-9-2)10-11(3,4)5/h6-7H,1H2,2-5H3
(3) InChIKey: SHALBPKEGDBVKK-UHFFFAOYAO