Propanoic acid,2-(2-ethoxy-2-oxoethoxy)-, ethyl ester supplier

Name
ethyl 2-(2-ethoxy-2-oxoethoxy)propionate
EINECS 228-629-8
CAS No. 6309-62-2
Article Data4
CAS DataBase
Density 1.07 g/cm³
Solubility
Melting Point
Formula C₉H₁₆O₅
Boiling Point 260.866 °C at 760 mmHg
Molecular Weight 204.223
Flash Point 108.437 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Propionicacid, 2-(carboxymethoxy)-, diethyl ester (8CI);Diethyl 2-methyldiglycolate;NSC 41607;
PSA 61.83000
LogP 0.51770

Propanoic acid,2-(2-ethoxy-2-oxoethoxy)-, ethyl ester Specification

The Propanoic acid,2-(2-ethoxy-2-oxoethoxy)-, ethyl ester, with the CAS registry number 6309-62-2, is also known as 2-(2-Ethoxy-2-oxoethoxy)propanoic acid ethyl ester. Its EINECS registry number is 228-629-8. This chemical's molecular formula is C₉H₁₆O₅ and molecular weight is 204.22. What's more, both its IUPAC name and systematic name are the same which is called Ethyl 2-(2-ethoxy-2-oxoethoxy)propanoate.

Physical properties about Propanoic acid,2-(2-ethoxy-2-oxoethoxy)-, ethyl ester are: (1)ACD/LogP: 1.498; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.50; (4)ACD/LogD (pH 7.4): 1.50; (5)ACD/BCF (pH 5.5): 8.11; (6)ACD/BCF (pH 7.4): 8.11; (7)ACD/KOC (pH 5.5): 155.63; (8)ACD/KOC (pH 7.4): 155.63; (9)#H bond acceptors: 5; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 8; (12)Polar Surface Area: 61.83 Å²; (13)Index of Refraction: 1.427; (14)Molar Refractivity: 48.998 cm³; (15)Molar Volume: 190.8 cm³; (16)Polarizability: 19.424×10^-24cm³; (17)Surface Tension: 32.834 dyne/cm; (18) Density: 1.07 g/cm³; (19)Flash Point: 108.437 °C; (20) Enthalpy of Vaporization: 49.858 kJ/mol; (21)Boiling Point: 260.866 °C at 760 mmHg; (22)Vapour Pressure: 0.0120 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(OCC)COC(C(=O)OCC)C
(2) InChI: InChI=1S/C9H16O5/c1-4-12-8(10)6-14-7(3)9(11)13-5-2/h7H,4-6H2,1-3H3
(3) InChIKey: SFEWOHUGHVHUCA-UHFFFAOYSA-N

Product Name

ethyl 2-(2-ethoxy-2-oxoethoxy)propionate

Propanoic acid,2-(2-ethoxy-2-oxoethoxy)-, ethyl ester Specification

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