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Name
9-[2-(2-methoxyethoxy)ethoxy]-9-[3-(oxiranylmethoxy)propyl]-2,5,8,10,13,16-hexaoxa-9-silaheptadecane
- EINECS 289-390-3
- CAS No. 88127-84-8
- Density 1.084g/cm3
- Solubility 174g/L at 20℃
- Melting Point
- Formula C21H44 O11 Si
- Boiling Point 504.5°C at 760 mmHg
- Molecular Weight 500.65296
- Flash Point 210.6°C
- Transport Information
- Appearance
- Safety
- Risk Codes
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Molecular Structure
- Hazard Symbols
- Synonyms 2,5,8,10,13,16-Hexaoxa-9-silaheptadecane,9-[2-(2-methoxyethoxy)ethoxy]-9-[3-(oxiranylmethoxy)propyl]- (9CI);
- PSA 104.83000
- LogP 0.76960
9-[2-(2-methoxyethoxy)ethoxy]-9-[3-(oxiranylmethoxy)propyl]-2,5,8,10,13,16-hexaoxa-9-silaheptadecane Specification
The 9-[2-(2-methoxyethoxy)ethoxy]-9-[3-(oxiranylmethoxy)propyl]-2,5,8,10,13,16-hexaoxa-9-silaheptadecane,with the CAS registry number 88127-84-8.It belongs to the product categories of Organic Chemistry ,customized products.This chemical's molecular formula is C21H44O11Si and molecular weight is 500.65.What's more,its systematic name is Benzenamine,3-chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-.
Physical properties about 9-[2-(2-methoxyethoxy)ethoxy]-9-[3-(oxiranylmethoxy)propyl]-2,5,8,10,13,16-hexaoxa-9-silaheptadecane are:(1)ACD/LogP: -0.77; (2)# of Rule of 5 Violations: 2 ; (3)ACD/LogD (pH 5.5): -0.77; (4)ACD/LogD (pH 7.4): -0.77; (5)ACD/BCF (pH 5.5): 1.00; (6)ACD/BCF (pH 7.4): 1.00; (7)ACD/KOC (pH 5.5): 9.09; (8)ACD/KOC (pH 7.4): 9.09; (9)#H bond acceptors: 11; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 27; (12)Polar Surface Area: 104.83 ?2; (13)Index of Refraction: 1.454; (14)Molar Refractivity: 125.083 cm3; (15)Molar Volume: 461.83 cm3; (16)Polarizability: 49.587×10-24cm3; (17)Surface Tension: 34.7109985351563 dyne/cm; (18)Density: 1.084 g/cm3; (19)Flash Point: 210.649 °C; (20)Enthalpy of Vaporization: 74.462 kJ/mol; (21)Boiling Point: 504.454 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES:COCCOCCO[Si](CCCOCC1CO1)(OCCOCCOC)OCCOCCOC;
(2)Std.InChI:InChI=1S/C21H44O11Si/c1-22-6-9-25-12-15-30-33(31-16-13-26-10-7-23-2,32-17-14-27-11-8-24-3)18-4-5-28-19-21-20-29-21/h21H,4-20H2,1-3H3;
(3)Std.InChIKey:BAPRPWHVXHPSHD-UHFFFAOYSA-N;
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