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114435-02-8

Basic Information
CAS No.: 114435-02-8
Name: 1,3-Dioxolan-2-one,4-fluoro-
Molecular Structure:
Molecular Structure of 114435-02-8 (1,3-Dioxolan-2-one,4-fluoro-)
Formula: C3H3FO3
Molecular Weight: 106.05
Synonyms: Fluoroethylene carbonate;
EINECS: 483-360-5
Density: 1.41 g/cm3
Melting Point: 18-23℃
Boiling Point: 249.5 °C at 760 mmHg
Flash Point: 101.7 °C
Solubility: Slightly miscible with water.
Appearance:
Hazard Symbols: Xn
Risk Codes: 22-36/38-43-48/22
Safety: 26-36/37
Transport Information:
PSA: 35.53000
LogP: 0.44880
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Specification

The 1,3-Dioxolan-2-one,4-fluoro-, with the CAS registry number 114435-02-8, has the IUPAC name of 4-fluoro-1,3-dioxolan-2-one. And the molecular formula of this chemical is C3H3FO3. It is a kind of organic compound, and should be stored in the dry and cool environment.

The physical properties of 1,3-Dioxolan-2-one,4-fluoro- are as following: (1)ACD/LogP: -0.92; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.92; (4)ACD/LogD (pH 7.4): -0.92; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 7.55; (8)ACD/KOC (pH 7.4): 7.55; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 35.53 Å2; (13)Index of Refraction: 1.384; (14)Molar Refractivity: 17.58 cm3; (15)Molar Volume: 75 cm3; (16)Polarizability: 6.96×10-24cm3; (17)Surface Tension: 28.4 dyne/cm; (18)Density: 1.41 g/cm3; (19)Flash Point: 101.7 °C; (20)Enthalpy of Vaporization: 48.67 kJ/mol; (21)Boiling Point: 249.5 °C at 760 mmHg; (22)Vapour Pressure: 0.0228 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C1OCC(F)O1
(2)InChI: InChI=1/C3H3FO3/c4-2-1-6-3(5)7-2/h2H,1H2
(3)InChIKey: SBLRHMKNNHXPHG-UHFFFAOYAT

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