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CAS No.: | 57267-03-5 |
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Name: | acetic acid, triethoxy-, ethyl ester |
Article Data: | 7 |
Molecular Structure: | |
Formula: | C10H20O5 |
Molecular Weight: | 220.266 |
Synonyms: | Aceticacid, triethoxy-, ethyl ester (9CI);Ethyl triethoxyacetate;Triethoxyaceticacid ethyl ester; |
Density: | 1.018g/cm3 |
Boiling Point: | 267.9 °C at 760 mmHg |
Flash Point: | 110.7 °C |
PSA: | 53.99000 |
LogP: | 1.31280 |
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The Ethyl triethoxyacetate with the CAS number 57267-03-5 is also called Acetic acid,2,2,2-triethoxy-, ethyl ester. The IUPAC name is ethyl 2,2,2-triethoxyacetate. Its molecular formula is C10H20O5. This chemical is a kind of organics. It should be stored in dry and cool environment.
The properties of the chemical are: (1)ACD/LogP: 5.00; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 5; (4)ACD/LogD (pH 7.4): 5; (5)ACD/BCF (pH 5.5): 3713.37; (6)ACD/BCF (pH 7.4): 3713.37; (7)ACD/KOC (pH 5.5): 12497.82; (8)ACD/KOC (pH 7.4): 12497.82; (9)#H bond acceptors: 5; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 9; (12)Polar Surface Area: 53.99Å2; (13)Index of Refraction: 1.425; (14)Molar Refractivity: 55.35 cm3; (15)Molar Volume: 216.2 cm3; (16)Polarizability: 21.94×10-24cm3; (17)Surface Tension: 30.6 dyne/cm; (18)Enthalpy of Vaporization: 50.6 kJ/mol; (19)Vapour Pressure: 0.00792 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OCC)C(OCC)(OCC)OCC
(2)InChI: InChI=1/C10H20O5/c1-5-12-9(11)10(13-6-2,14-7-3)15-8-4/h5-8H2,1-4H3
(3)InChIKey: JWQIAVCJLYNXLJ-UHFFFAOYAD