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Propanoic acid,3-fluoro-2-oxo-, ethyl ester

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Name

Propanoic acid,3-fluoro-2-oxo-, ethyl ester

EINECS
CAS No. 760-10-1 Density 1.145 g/cm3
Solubility Melting Point
Formula C5H7FO3 Boiling Point 153.5 °C at 760 mmHg
Molecular Weight 134.1057 Flash Point 46 °C
Transport Information Appearance
Safety Risk Codes
Molecular Structure Molecular Structure of 760-10-1 (Propanoic acid,3-fluoro-2-oxo-, ethyl ester) Hazard Symbols
Synonyms

Pyruvicacid, fluoro-, ethyl ester (7CI,8CI);

 

Propanoic acid,3-fluoro-2-oxo-, ethyl ester Specification

The CAS registry number of Propanoic acid,3-fluoro-2-oxo-, ethyl ester is 760-10-1. This chemical is also named as 3-Fluoropyruvic acid ethyl ester. In addition, its molecular formula is C5H7FO3 and molecular weight is 134.1057. Its systematic name is called ethyl 3-fluoro-2-oxo-propanoate.

Physical properties about Propanoic acid,3-fluoro-2-oxo-, ethyl ester are: (1)ACD/LogP: 0.11; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.11; (4)ACD/LogD (pH 7.4): 0.11; (5)#H bond acceptors: 3; (6)#H bond donors: 0; (7)#Freely Rotating Bonds: 4; (8)Index of Refraction: 1.38; (9)Molar Refractivity: 27.18 cm3; (10)Molar Volume: 117.1 cm3; (11)Surface Tension: 28.4 dyne/cm; (12)Density: 1.145 g/cm3; (13)Flash Point: 46 °C; (14)Enthalpy of Vaporization: 39.03 kJ/mol; (15)Boiling Point: 153.5 °C at 760 mmHg; (16)Vapour Pressure: 3.32 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: FCC(=O)C(=O)OCC
(2)InChI: InChI=1/C5H7FO3/c1-2-9-5(8)4(7)3-6/h2-3H2,1H3
(3)InChIKey: SQZVUWRQYOJFGZ-UHFFFAOYAV

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