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| CAS No.: | 3959-13-5 |
|---|---|
| Name: | methylphenylsilanediol |
| Article Data: | 17 |
| Molecular Structure: | |
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| Formula: | C7H10O2Si |
| Molecular Weight: | 154.241 |
| Synonyms: | Silanediol,methylphenyl- (6CI,7CI,8CI,9CI);Dihydroxymethylphenylsilane;Methylphenylsilanediol;Phenylmethylsilanediol; |
| EINECS: | 223-562-0 |
| Density: | 1.12 g/cm3 |
| Boiling Point: | 250.6 °C at 760 mmHg |
| Flash Point: | 105.4 °C |
| PSA: | 40.46000 |
| LogP: | -0.04980 |
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- Total:34 Page 1 of 1 1
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Specification
The Silanediol,1-methyl-1-phenyl-, with CAS registry number 3959-13-5, has the systematic name of methyl(phenyl)silanediol. Besides this, it is also called Phenyl(methyl)dihydroxysilane. And the chemical formula of this chemical is C7H10O2Si.
Physical properties of Silanediol,1-methyl-1-phenyl-: (1)ACD/LogP: 2.66; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.66; (4)ACD/LogD (pH 7.4): 2.66; (5)ACD/BCF (pH 5.5): 62.01; (6)ACD/BCF (pH 7.4): 62.01; (7)ACD/KOC (pH 5.5): 667.83; (8)ACD/KOC (pH 7.4): 667.83; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 18.46 Å2; (13)Index of Refraction: 1.542; (14)Molar Refractivity: 43.2 cm3; (15)Molar Volume: 137.2 cm3; (16)Polarizability: 17.12×10-24cm3; (17)Surface Tension: 36.6 dyne/cm; (18)Density: 1.12 g/cm3; (19)Flash Point: 105.4 °C; (20)Enthalpy of Vaporization: 51.55 kJ/mol; (21)Boiling Point: 250.6 °C at 760 mmHg; (22)Vapour Pressure: 0.0112 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O[Si](O)(c1ccccc1)C
(2)InChI: InChI=1/C7H10O2Si/c1-10(8,9)7-5-3-2-4-6-7/h2-6,8-9H,1H3
(3)InChIKey: RBSBUSKLSKHTBA-UHFFFAOYAI
(4)Std. InChI: InChI=1S/C7H10O2Si/c1-10(8,9)7-5-3-2-4-6-7/h2-6,8-9H,1H3
(5)Std. InChIKey: RBSBUSKLSKHTBA-UHFFFAOYSA-N