-
Name
2-(Acetyloxymethoxy)ethoxymethyl acetate
- EINECS
- CAS No. 90114-17-3
- Article Data3
- CAS DataBase
- Density 1.144 g/cm3
- Solubility
- Melting Point
- Formula C8H14O6
- Boiling Point 254.36 °C at 760 mmHg
- Molecular Weight 206.196
- Flash Point 105.564 °C
- Transport Information
- Appearance
- Safety
- Risk Codes
-
Molecular Structure
- Hazard Symbols
- Synonyms Aceticacid, ethylenebis(oxymethylene) ester (6CI);NSC 57560;1,2-Ethanediylbis(oxymethylene) diacetate;Methanol,(ethylenedioxy)di-, diacetate (7CI);
- PSA 71.06000
- LogP 0.06080
2-(Acetyloxymethoxy)ethoxymethyl acetate Specification
The 2-(Acetyloxymethoxy)ethoxymethyl acetate, with the CAS registry number 90114-17-3, is also known as Aceticacid, ethylenebis(oxymethylene) ester. This chemical's molecular formula is C8H14O6 and molecular weight is 206.08. What's more, its systematic name is 1,2-Ethanediylbis(oxymethylene) diacetate.
Physical properties of 2-(Acetyloxymethoxy)ethoxymethyl acetate are: (1)ACD/LogP: 0.138; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.14; (4)ACD/LogD (pH 7.4): 0.14; (5)ACD/BCF (pH 5.5): 1.00; (6)ACD/BCF (pH 7.4): 1.00; (7)ACD/KOC (pH 5.5): 28.32; (8)ACD/KOC (pH 7.4): 28.32; (9)#H bond acceptors: 6; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 9; (12)Polar Surface Area: 71.06 Å2; (13)Index of Refraction: 1.426; (14)Molar Refractivity: 46.152 cm3; (15)Molar Volume: 180.279 cm3; (16)Polarizability: 18.296×10-24cm3; (17)Surface Tension: 35.24 dyne/cm; (18)Density: 1.144 g/cm3; (19)Flash Point: 105.564 °C; (20)Enthalpy of Vaporization: 49.179 kJ/mol; (21)Boiling Point: 254.36 °C at 760 mmHg; (22)Vapour Pressure: 0.017 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OCOCCOCOC(=O)C)C
(2)Std. InChI: InChI=1S/C8H14O6/c1-7(9)13-5-11-3-4-12-6-14-8(2)10/h3-6H2,1-2H3
(3)Std. InChIKey: JCWJORVNWIULDI-UHFFFAOYSA-N
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