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68208-09-3

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Basic Information
CAS No.: 68208-09-3
Name: 5-ETHOXY-2-ETHOXYCARBONYLOXAZOLE
Article Data: 5
Molecular Structure:
Molecular Structure of 68208-09-3 (5-ETHOXY-2-ETHOXYCARBONYLOXAZOLE)
Formula: C8H11NO4
Molecular Weight: 185.18
Synonyms: 5-Ethoxy-2-ethoxycarbonyloxazole;
Density: 1.154 g/cm3
Boiling Point: 260.8 °C at 760 mmHg
Flash Point: 111.5 °C
PSA: 61.56000
LogP: 1.25000
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Specification

The 2-Oxazolecarboxylicacid, 5-ethoxy-, ethyl ester, with the CAS registry number of 68208-09-3, is also known as 5-Ethoxy-2-ethoxycarbonyloxazole. Its molecular formula is C8H11NO4 and molecular weight is 185.1772. What's more, its systematic name is Ethyl 5-ethoxy-1,3-oxazole-2-carboxylate.

Physical properties about the 2-Oxazolecarboxylicacid, 5-ethoxy-, ethyl ester are: (1)ACD/LogP: 1.22; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 5; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 5; (6)Polar Surface Area: 61.56 Å2; (7)Index of Refraction: 1.465; (8)Molar Refractivity: 44.36 cm3; (9)Molar Volume: 160.3 cm3; (10)Surface Tension: 37.3 dyne/cm; (11)Density: 1.154 g/cm3; (12)Flash Point: 111.5 °C; (13)Enthalpy of Vaporization: 49.85 kJ/mol; (14)Boiling Point: 260.8 °C at 760 mmHg; (15)Vapour Pressure: 0.012 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(OCC)c1ncc(OCC)o1
(2) InChI: InChI=1/C8H11NO4/c1-3-11-6-5-9-7(13-6)8(10)12-4-2/h5H,3-4H2,1-2H3
(3) InChIKey: WZWPVIAZPSGFHJ-UHFFFAOYAN