- InChI
- InChI=1S/C3H6O3/c1-3(5)6-2-4/h4H,2H2,1H3
- InChI Key
- JYVNDCLJHKQUHE-UHFFFAOYSA-N
- Formula
- C3H6O3
- SMILES
- CC(=O)OCO
- Molecular Weight1
- 90.08
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- Cp,liquid : Liquid phase heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (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).
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (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 |
|---|---|---|---|
| ω | 0.6125 | Relay (1.0) Calculated Property | |
| ΔfG° | -472.81 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -604.02 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 11.98 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 56.19 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.27 | eV | Relay (1.0) Calculated Property |
| log10WS | 0.83 | Relay (1.0) Calculated Property | |
| logPoct/wat | -0.501 | Crippen Calculated Property | |
| McVol | 66.440 | ml/mol | McGowan Calculated Property |
| Pc | 5037.07 | kPa | Joback Calculated Property |
| Tboil | 407.76 | K | Relay (1.0) Calculated Property |
| Tc | 626.64 | K | Relay (1.0) Calculated Property |
| Tfus | 206.68 | K | Relay (1.0) Calculated Property |
| Vc | 0.245 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,liquid | 214.00 | J/mol×K | 298.15 | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [97.96; 200.88] | J/mol×K | [273.00; 1000.00] |
Joback Predicted correlation
|
| Equation | Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K | |||
| Coefficient A | 3.08610e+01 | |||
| Coefficient B | 2.68020e-01 | |||
| Coefficient C | -7.52000e-05 | |||
| Coefficient D | -2.28000e-08 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 97.96 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 115.26 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 131.26 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 145.89 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 159.08 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 170.75 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 180.84 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 189.28 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 195.98 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 200.88 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0656429; 0.0003041] | Pa×s | [226.72; 412.93] |
Joback Predicted correlation
|
| Equation | Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K | |||
| Coefficient A | -1.46423e+01 | |||
| Coefficient B | 2.70223e+03 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Comment | Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc. | |||
| Temperature range, min. | 226.72 | |||
| Temperature range, max. | 412.93 | |||
| η | 0.0656429 | Pa×s | 226.72 | Calculated Property |
| η | 0.0242280 | Pa×s | 247.41 | Calculated Property |
| η | 0.0104294 | Pa×s | 268.10 | Calculated Property |
| η | 0.0050658 | Pa×s | 288.79 | Calculated Property |
| η | 0.0027100 | Pa×s | 309.48 | Calculated Property |
| η | 0.0015680 | Pa×s | 330.17 | Calculated Property |
| η | 0.0009677 | Pa×s | 350.86 | Calculated Property |
| η | 0.0006302 | Pa×s | 371.55 | Calculated Property |
| η | 0.0004294 | Pa×s | 392.24 | Calculated Property |
| η | 0.0003041 | Pa×s | 412.93 | Calculated Property |
Similar Compounds
Find more compounds similar to Methylene glycol monoacetate.
Sources
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