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17876-90-3

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Basic Information
CAS No.: 17876-90-3
Name: 3-(TRIMETHYLSILYL)ANISOLE
Article Data: 13
Molecular Structure:
Molecular Structure of 17876-90-3 (3-(TRIMETHYLSILYL)ANISOLE)
Formula: C10H16OSi
Molecular Weight: 180.322
Synonyms: Silane,(3-methoxyphenyl)trimethyl- (9CI);Silane, (m-methoxyphenyl)trimethyl-(6CI,8CI);(m-Methoxyphenyl)trimethylsilane;3-Anisyltrimethylsilane;m-(Trimethylsilyl)anisole;m-Anisyltrimethylsilane;
Density: 0.91 g/cm3
Boiling Point: 208.8 °C at 760 mmHg
Flash Point: 60.8 °C
Appearance: clear colorless to slightly yellow liquid
PSA: 9.23000
LogP: 2.24040
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Specification

The Benzene, 1-methoxy-3-(trimethylsilyl)-, with the CAS registry number 17876-90-3, is also known as 3-(Trimethylsilyl)anisole. This chemical's molecular formula is C10H16OSi and molecular weight is 180.32. What's more, its systematic name is (3-Methoxyphenyl)(trimethyl)silane.

Physical properties about Benzene, 1-methoxy-3-(trimethylsilyl)- are: (1)ACD/LogP: 4.64; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.64; (4)ACD/LogD (pH 7.4): 4.64; (5)ACD/BCF (pH 5.5): 1962.82; (6)ACD/BCF (pH 7.4): 1962.82; (7)ACD/KOC (pH 5.5): 7918.46; (8)ACD/KOC (pH 7.4): 7918.46; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 9.23 Å2; (13)Index of Refraction: 1.476; (14)Molar Refractivity: 55.75 cm3; (15)Molar Volume: 197.3 cm3; (16)Polarizability: 22.1×10-24 cm3; (17)Surface Tension: 25.2 dyne/cm; (18)Density: 0.91 g/cm3; (19)Flash Point: 60.8 °C; (20)Enthalpy of Vaporization: 42.69 kJ/mol; (21)Boiling Point: 208.8 °C at 760 mmHg; (22)Vapour Pressure: 0.302 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O(c1cc(ccc1)[Si](C)(C)C)C
(2) InChI: InChI=1/C10H16OSi/c1-11-9-6-5-7-10(8-9)12(2,3)4/h5-8H,1-4H3
(3) InChIKey: JNMGPIRHEVSHJR-UHFFFAOYAE