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CAS No.: | 17945-05-0 |
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Name: | TRIETHOXYSILYLPROPYLETHYLCARBAMATE |
Article Data: | 6 |
Molecular Structure: | |
Formula: | C12H27NO5Si |
Molecular Weight: | 293.436 |
Synonyms: | Carbamicacid, [3-(triethoxysilyl)propyl]-, ethyl ester (8CI,9CI);Ethyl3-(triethoxysilyl)propylcarbamate;Ethyl g-triethoxysilylpropylcarbamate;Y 15272; |
EINECS: | 241-872-4 |
Density: | 0.998 g/cm3 |
Melting Point: | <0 °C |
Boiling Point: | 332.2 °C at 760 mmHg |
Flash Point: | 154.7 °C |
Risk Codes: | 36/37/38 |
Safety: | 26-36/37/39 |
PSA: | 66.02000 |
LogP: | 2.56190 |
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This chemical is called Carbamic acid,N-[3-(triethoxysilyl)propyl]-, ethyl ester, and its systematic name is Ethyl [3-(triethoxysilyl)propyl]carbamate. With the molecular formula of C12H27NO5Si, its molecular weight is 293.43. The CAS registry number of the chemical is 17945-05-0.
Other characteristics of Carbamic acid,N-[3-(triethoxysilyl)propyl]-, ethyl ester can be summarised as followings: (1)ACD/LogP: 2.46; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.46; (4)ACD/LogD (pH 7.4): 2.46; (5)ACD/BCF (pH 5.5): 43.41; (6)ACD/BCF (pH 7.4): 43.41; (7)ACD/KOC (pH 5.5): 517.35; (8)ACD/KOC (pH 7.4): 517.35; (9)#H bond acceptors: 6; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 12; (12)Polar Surface Area: 57.23 Å2; (13)Index of Refraction: 1.437; (14)Molar Refractivity: 76.96 cm3; (15)Molar Volume: 293.7 cm3; (16)Polarizability: 30.51×10-24cm3; (17)Surface Tension: 28.7 dyne/cm; (18)Density: 0.998 g/cm3; (19)Flash Point: 154.7 °C; (20)Enthalpy of Vaporization: 57.49 kJ/mol; (21)Boiling Point: 332.2 °C at 760 mmHg; (22)Vapour Pressure: 0.000148 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following: This chemical is irritating to eyes, respiratory system and skin. Wear suitable protective clothing, gloves and eye/face protection when you use it. In case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
1.SMILES: O=C(OCC)NCCC[Si](OCC)(OCC)OCC
2.InChI: InChI=1/C12H27NO5Si/c1-5-15-12(14)13-10-9-11-19(16-6-2,17-7-3)18-8-4/h5-11H2,1-4H3,(H,13,14)
3.InChIKey: MVUXVDIFQSGECB-UHFFFAOYAN
4.Std. InChI: InChI=1S/C12H27NO5Si/c1-5-15-12(14)13-10-9-11-19(16-6-2,17-7-3)18-8-4/h5-11H2,1-4H3,(H,13,14)
5.Std. InChIKey: MVUXVDIFQSGECB-UHFFFAOYSA-N