- InChI
- InChI=1S/C3H4O3/c4-3-5-1-2-6-3/h1-2H2
- InChI Key
- KMTRUDSVKNLOMY-UHFFFAOYSA-N
- Formula
- C3H4O3
- SMILES
- O=C1OCCO1
- Molecular Weight1
- 88.06
- CAS
- 96-49-1
- Other Names
-
- 1,3-Dioxacyclopentan-2-one
- 2-Dioxolone
- CYCLIC ETHYLENE CARBONATE
- Carbonic acid, cyclic ethylene ester
- Dioxolone-2
- ETHYLENE CARBONATE
- ETHYLENE GLYCOL CARBONATE
- Ethylene glycol, cyclic carbonate
- Ethylenester kyseliny uhlicite
- Glycol carbonate
- NSC 11801
- Texacar EC
- carbonic acid, ethylene ester
- PAff : Proton affinity (kJ/mol).
- BasG : Gas basicity (kJ/mol).
- ΔcH°liquid : Standard liquid enthalpy of combustion (kJ/mol).
- ΔcH°solid : Standard solid enthalpy of combustion (kJ/mol).
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- Cp,liquid : Liquid phase heat capacity (J/mol×K).
- Cp,solid : Solid phase heat capacity (J/mol×K).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfH°liquid : Liquid phase enthalpy of formation at standard conditions (kJ/mol).
- ΔfH°solid : Solid phase enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔfusH : Enthalpy of fusion at a given temperature (kJ/mol).
- ΔsubH : Enthalpy of sublimation at a given temperature (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- ΔvapH : Enthalpy of vaporization at a given temperature (kJ/mol).
- IE : Ionization energy (eV).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Pvap : Vapor pressure (kPa).
- ρl : Liquid Density (kg/m3).
- ρs : Solid Density (kg/m3).
- ΔfusS : Entropy of fusion at a given temperature (J/mol×K).
- S°solid,1 bar : Solid phase molar entropy at standard conditions (J/mol×K).
- Tboil : Normal Boiling Point Temperature (K).
- Tboilr : Boiling point at reduced pressure (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Ttriple : Triple Point Temperature (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| PAff | 814.20 | kJ/mol | NIST |
| BasG | 784.40 | kJ/mol | NIST |
| ΔcH°liquid | -1069.30 ± 2.10 | kJ/mol | NIST |
| ΔcH°solid | [-1171.32; -1161.40] | kJ/mol |
|
| ΔcH°solid | -1161.40 | kJ/mol | NIST |
| ΔcH°solid | -1165.90 ± 3.70 | kJ/mol | NIST |
| ΔcH°solid | -1170.60 ± 0.40 | kJ/mol | NIST |
| ΔcH°solid | -1171.32 | kJ/mol | NIST |
| ΔfG° | -276.19 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -503.00 ± 4.20 | kJ/mol | NIST |
| ΔfH°liquid | -682.80 ± 2.10 | kJ/mol | NIST |
| ΔfH°solid | [-590.90; -581.60] | kJ/mol |
|
| ΔfH°solid | -590.90 | kJ/mol | NIST |
| ΔfH°solid | -586.30 ± 3.80 | kJ/mol | NIST |
| ΔfH°solid | -581.60 ± 0.40 | kJ/mol | NIST |
| ΔfusH° | 11.86 | kJ/mol | Joback Calculated Property |
| ΔvapH° | [60.80; 179.80] | kJ/mol |
|
| ΔvapH° | 60.80 ± 0.10 | kJ/mol | NIST |
| ΔvapH° | 64.00 ± 0.10 | kJ/mol | NIST |
| ΔvapH° | 63.40 ± 0.30 | kJ/mol | NIST |
| ΔvapH° | 78.50 ± 4.20 | kJ/mol | NIST |
| ΔvapH° | Outlier 179.80 | kJ/mol | NIST |
| ΔvapH° | 62.40 | kJ/mol | NIST |
| IE | [10.40; 11.47] | eV |
|
| IE | 10.40 | eV | NIST |
| IE | 10.40 | eV | NIST |
| IE | 10.70 | eV | NIST |
| IE | 11.10 | eV | NIST |
| IE | 11.47 | eV | NIST |
| log10WS | 0.10 | Crippen Calculated Property | |
| logPoct/wat | 0.153 | Crippen Calculated Property | |
| McVol | 55.580 | ml/mol | McGowan Calculated Property |
| Pc | 6141.84 | kPa | Joback Calculated Property |
| S°solid,1 bar | [132.54; 132.54] | J/mol×K |
|
| S°solid,1 bar | 132.54 | J/mol×K | NIST |
| S°solid,1 bar | 132.54 | J/mol×K | NIST |
| Tboil | 409.71 | K | Joback Calculated Property |
| Tc | 635.21 | K | Joback Calculated Property |
| Tfus | [308.53; 312.95] | K |
|
| Tfus | 308.53 | K | Efficie... |
| Tfus | 311.15 | K | Charact... |
| Tfus | 308.90 ± 0.80 | K | NIST |
| Tfus | Outlier 312.95 ± 0.20 | K | NIST |
| Tfus | 309.65 ± 0.15 | K | NIST |
| Tfus | 309.45 ± 0.20 | K | NIST |
| Tfus | 311.15 ± 1.50 | K | NIST |
| Tfus | 308.95 ± 0.50 | K | NIST |
| Tfus | 309.50 ± 0.60 | K | NIST |
| Ttriple | [309.47; 309.49] | K |
|
| Ttriple | 309.49 | K | KDB |
| Ttriple | 309.47 ± 0.00 | K | NIST |
| Ttriple | 309.49 ± 0.02 | K | NIST |
| Vc | 0.195 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [105.45; 147.91] | J/mol×K | [409.71; 635.21] |
|
|
T(K) Ideal gas heat capacity (J/mol×K) 110 120 130 140 150 450 500 550 600 | ||||
| Cp,gas | 105.45 | J/mol×K | 409.71 | Joback Calculated Property |
| Cp,gas | 113.28 | J/mol×K | 447.29 | Joback Calculated Property |
| Cp,gas | 120.83 | J/mol×K | 484.88 | Joback Calculated Property |
| Cp,gas | 128.08 | J/mol×K | 522.46 | Joback Calculated Property |
| Cp,gas | 135.02 | J/mol×K | 560.05 | Joback Calculated Property |
| Cp,gas | 141.63 | J/mol×K | 597.63 | Joback Calculated Property |
| Cp,gas | 147.91 | J/mol×K | 635.21 | Joback Calculated Property |
| Cp,liquid | [133.90; 158.51] | J/mol×K | [323.15; 398.15] |
|
|
T(K) Liquid phase heat capacity (J/mol×K) 135 140 145 150 155 160 340 360 380 | ||||
| Cp,liquid | 133.90 | J/mol×K | 323.15 | NIST |
| Cp,liquid | 155.87 | J/mol×K | 383.15 | Vapor P... |
| Cp,liquid | 156.75 | J/mol×K | 388.15 | Vapor P... |
| Cp,liquid | 157.63 | J/mol×K | 393.15 | Vapor P... |
| Cp,liquid | 158.51 | J/mol×K | 398.15 | Vapor P... |
| Cp,solid | [117.44; 117.44] | J/mol×K | [298.15; 298.15] |
|
| Cp,solid | 117.44 | J/mol×K | 298.15 | NIST |
| Cp,solid | 117.44 | J/mol×K | 298.15 | NIST |
| ΔfusH | [13.02; 13.30] | kJ/mol | [309.49; 311.20] |
|
|
T(K) Enthalpy of fusion at a given temperature (kJ/mol) 13 13.05 13.1 13.15 13.2 13.25 13.3 309.5 310 310.5 311 | ||||
| ΔfusH | 13.29 | kJ/mol | 309.49 | NIST |
| ΔfusH | 13.29 | kJ/mol | 309.49 | NIST |
| ΔfusH | 13.30 | kJ/mol | 309.50 | NIST |
| ΔfusH | 13.30 | kJ/mol | 309.50 | NIST |
| ΔfusH | 13.02 | kJ/mol | 311.20 | NIST |
| ΔsubH | 68.70 | kJ/mol | 285.00 | NIST |
| ΔvapH | [55.00; 60.30] | kJ/mol | [400.50; 423.00] |
|
|
T(K) Enthalpy of vaporization at a given temperature (kJ/mol) 55 56 57 58 59 60 400 410 420 | ||||
| ΔvapH | 55.00 | kJ/mol | 400.50 | NIST |
| ΔvapH | 60.30 | kJ/mol | 408.50 | NIST |
| ΔvapH | 56.30 | kJ/mol | 408.50 | NIST |
| ΔvapH | 59.60 | kJ/mol | 409.00 | NIST |
| ΔvapH | 56.48 | kJ/mol | 423.00 | NIST |
| Pvap | [0.01; 0.47] | kPa | [310.30; 369.50] |
|
|
T(K) Vapor pressure (kPa) 0 0.1 0.2 0.3 0.4 0.5 320 340 360 | ||||
| Pvap | 0.01 | kPa | 310.30 | Vapour ... |
| Pvap | 0.02 | kPa | 314.40 | Vapour ... |
| Pvap | 0.02 | kPa | 314.50 | Vapour ... |
| Pvap | 0.02 | kPa | 317.30 | Vapour ... |
| Pvap | 0.02 | kPa | 320.30 | Vapour ... |
| Pvap | 0.02 | kPa | 320.40 | Vapour ... |
| Pvap | 0.03 | kPa | 323.50 | Vapour ... |
| Pvap | 0.03 | kPa | 324.40 | Vapour ... |
| Pvap | 0.04 | kPa | 327.40 | Vapour ... |
| Pvap | 0.04 | kPa | 328.60 | Vapour ... |
| Pvap | 0.05 | kPa | 331.30 | Vapour ... |
| Pvap | 0.04 | kPa | 333.15 | Low pre... |
| Pvap | 0.06 | kPa | 333.60 | Vapour ... |
| Pvap | 0.07 | kPa | 335.40 | Vapour ... |
| Pvap | 0.07 | kPa | 338.15 | Low pre... |
| Pvap | 0.08 | kPa | 338.70 | Vapour ... |
| Pvap | 0.10 | kPa | 341.40 | Vapour ... |
| Pvap | 0.10 | kPa | 342.30 | Vapour ... |
| Pvap | 0.09 | kPa | 343.15 | Low pre... |
| Pvap | 0.11 | kPa | 343.80 | Vapour ... |
| Pvap | 0.12 | kPa | 345.20 | Vapour ... |
| Pvap | 0.14 | kPa | 347.60 | Vapour ... |
| Pvap | 0.12 | kPa | 348.15 | Low pre... |
| Pvap | 0.15 | kPa | 349.00 | Vapour ... |
| Pvap | 0.19 | kPa | 352.40 | Vapour ... |
| Pvap | 0.17 | kPa | 353.15 | Low pre... |
| Pvap | 0.20 | kPa | 354.00 | Vapour ... |
| Pvap | 0.25 | kPa | 357.50 | Vapour ... |
| Pvap | 0.26 | kPa | 358.90 | Vapour ... |
| Pvap | 0.29 | kPa | 360.60 | Vapour ... |
| Pvap | 0.33 | kPa | 363.20 | Vapour ... |
| Pvap | 0.35 | kPa | 364.10 | Vapour ... |
| Pvap | 0.40 | kPa | 366.70 | Vapour ... |
| Pvap | 0.47 | kPa | 369.50 | Vapour ... |
| ρl | [1315.70; 1350.00] | kg/m3 | [298.15; 318.15] |
|
| ρl | 1350.00 | kg/m3 | 298.15 | Low pre... |
| ρl | 1315.70 | kg/m3 | 318.15 | Solid-l... |
| ρs | 1320.00 | kg/m3 | 293.00 | Cyclic ... |
| ΔfusS | [42.96; 42.96] | J/mol×K | [309.49; 309.49] |
|
| ΔfusS | 42.96 | J/mol×K | 309.49 | NIST |
| ΔfusS | 42.96 | J/mol×K | 309.49 | NIST |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 516.70 | K | 98.70 | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 226.20] | kPa | [391.32; 552.31] |
The Yaw...
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.59477e+01 | |||
| Coefficient B | -5.16933e+03 | |||
| Coefficient C | -6.12240e+01 | |||
| Temperature range, min. | 391.32 | |||
| Temperature range, max. | 552.31 | |||
|
T(K) Vapor pressure (kPa) 0 50 100 150 200 400 450 500 550 | ||||
| Pvap | 1.33 | kPa | 391.32 | Calculated Property |
| Pvap | 2.98 | kPa | 409.21 | Calculated Property |
| Pvap | 6.17 | kPa | 427.10 | Calculated Property |
| Pvap | 11.91 | kPa | 444.98 | Calculated Property |
| Pvap | 21.70 | kPa | 462.87 | Calculated Property |
| Pvap | 37.57 | kPa | 480.76 | Calculated Property |
| Pvap | 62.18 | kPa | 498.65 | Calculated Property |
| Pvap | 98.92 | kPa | 516.53 | Calculated Property |
| Pvap | 151.94 | kPa | 534.42 | Calculated Property |
| Pvap | 226.20 | kPa | 552.31 | Calculated Property |
| Pvap | [6.83e-03; 6634.23] | kPa | [309.55; 790.00] |
KDB Vap...
|
| Equation | ln(Pvp) = A + B/T + C*ln(T) + D*T^2 | |||
| Coefficient A | 9.59483e+01 | |||
| Coefficient B | -1.14946e+04 | |||
| Coefficient C | -1.11778e+01 | |||
| Coefficient D | 3.17385e-06 | |||
| Temperature range, min. | 309.55 | |||
| Temperature range, max. | 790.00 | |||
|
T(K) Vapor pressure (kPa) 0 1000 2000 3000 4000 5000 6000 7000 400 600 800 | ||||
| Pvap | 6.83e-03 | kPa | 309.55 | Calculated Property |
| Pvap | 0.30 | kPa | 362.93 | Calculated Property |
| Pvap | 4.35 | kPa | 416.32 | Calculated Property |
| Pvap | 30.24 | kPa | 469.70 | Calculated Property |
| Pvap | 130.53 | kPa | 523.08 | Calculated Property |
| Pvap | 406.10 | kPa | 576.47 | Calculated Property |
| Pvap | 1003.29 | kPa | 629.85 | Calculated Property |
| Pvap | 2100.77 | kPa | 683.23 | Calculated Property |
| Pvap | 3900.82 | kPa | 736.62 | Calculated Property |
| Pvap | 6634.23 | kPa | 790.00 | Calculated Property |
Similar Compounds
Find more compounds similar to 1,3-Dioxolan-2-one.
Mixtures
- 1,3,2-Dioxathiolane, 2-oxide + 1,3-Dioxolan-2-one
- Tetrahydrofuran + 1,3-Dioxolan-2-one
- Acetonitrile + 1,3-Dioxolan-2-one
- Ethyl Acetate + 1,3-Dioxolan-2-one
- Ethane, 1,2-dimethoxy- + 1,3-Dioxolan-2-one
- lithium perchlorate + Tetrahydrofuran + 1,3-Dioxolan-2-one
- lithium bromide + Tetrahydrofuran + 1,3-Dioxolan-2-one
- Tetraethylammonium bromide + Tetrahydrofuran + 1,3-Dioxolan-2-one
- Tetra-N-butylammonium bromide + Tetrahydrofuran + 1,3-Dioxolan-2-one
- Acetonitrile + lithium perchlorate + 1,3-Dioxolan-2-one
- lithium bromide + Acetonitrile + 1,3-Dioxolan-2-one
- Acetonitrile + Tetraethylammonium bromide + 1,3-Dioxolan-2-one
- Acetonitrile + Tetra-N-butylammonium bromide + 1,3-Dioxolan-2-one
- Ethyl Acetate + lithium perchlorate + 1,3-Dioxolan-2-one
- lithium bromide + Ethyl Acetate + 1,3-Dioxolan-2-one
- Tetraethylammonium bromide + Ethyl Acetate + 1,3-Dioxolan-2-one
- Tetra-N-butylammonium bromide + Ethyl Acetate + 1,3-Dioxolan-2-one
- Ethane, 1,2-dimethoxy- + lithium perchlorate + 1,3-Dioxolan-2-one
- lithium bromide + Ethane, 1,2-dimethoxy- + 1,3-Dioxolan-2-one
- Tetraethylammonium bromide + Ethane, 1,2-dimethoxy- + 1,3-Dioxolan-2-one
Find more mixtures with 1,3-Dioxolan-2-one.
Sources
- KDB Vapor Pressure Data
- Crippen Method
- Crippen Method
- Vapour pressure and enthalpy of vaporization of cyclic alkylene carbonates
- Solid-liquid equilibria and thermo-physical properties of liquid electrolyte systems for lithium ion batteries
- Thermophysical properties of 1-ethyl-3-methylimidazolium bromide ionic liquid in water + ethylene carbonate mixtures at T = (298.2, 308.2 and 318.2) K
- Standard partial molar volumes of some electrolytes in ethylene carbonate based mixtures
- Liquid + liquid equilibria for ternary mixtures of (solvent + aromatic hydrocarbon + alkane)
- Cyclic alkylene carbonates. Experiment and first principle calculations for prediction of thermochemical properties
- Efficient determination of crystallisation and melting points at low cooling and heating rates with novel computer controlled equipment
- Separation of aromatic hydrocarbons (toluene or benzene) from aliphatic hydrocarbon (n-heptane) by extraction with ethylene carbonate
- Low pressure carbon dioxide solubility in pure electrolyte solvents for lithium-ion batteries as a function of temperature. Measurement and prediction
- Low pressure carbon dioxide solubility in lithium-ion batteries based electrolytes as a function of temperature. Measurement and prediction
- Low pressure methane solubility in lithium-ion batteries based solvents and electrolytes as a function of temperature. Measurement and prediction
- Phase equilibrium and activity coefficients in ternary systems at 298.15 K: RbCl/CsCl + ethylene carbonate + water
- Liquid liquid equilibria for mixtures of (ethylene carbonate + aromatic hydrocarbon + cyclohexane)
- Characterization on the exothermic behaviors of cathode materials reacted with ethylene carbonate in lithium-ion battery studied by differential scanning calorimeter (DSC)
- Measurement and Correlation of the Electrical Conductivity of the Ionic Liquid [BMIM][TFSI] in Binary Organic Solvents
- Infinite Dilution Activity Coefficients in Ethylene Glycol and Ethylene Carbonate
- Vapor Pressure and Liquid Heat Capacity of Alkylene Carbonates
- Isobaric Vapor-Liquid Equilibria of Binary Mixtures Containing the Carbonate Group -OCOO-
- Phase Equilibria in Binary Mixtures of Water with Cyclic Alkylene Carbonates
- Joback Method
- KDB
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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