- InChI
- InChI=1S/C11H22O4/c1-4-5-6-13-7-8-14-11(12)15-9-10(2)3/h10H,4-9H2,1-3H3
- InChI Key
- QRRRLNDORHTLRG-UHFFFAOYSA-N
- Formula
- C11H22O4
- SMILES
- CCCCOCCOC(=O)OCC(C)C
- Molecular Weight1
- 218.29
- ω : Acentric Factor.
- Cp,gas : Ideal gas 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).
- Inp : Non-polar retention indices.
- 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 | 0.7172 | Relay (1.0) Calculated Property | |
| ΔfG° | -481.07 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -881.46 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 27.47 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 71.49 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.79 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.23 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.612 | Crippen Calculated Property | |
| McVol | 185.030 | ml/mol | McGowan Calculated Property |
| Pc | 1898.60 | kPa | Joback Calculated Property |
| Inp | [1400.00; 1400.00] |
|
|
| Inp | 1400.00 | NIST | |
| Inp | 1400.00 | NIST | |
| Tboil | 516.84 | K | Relay (1.0) Calculated Property |
| Tc | 657.05 | K | Relay (1.0) Calculated Property |
| Tfus | 196.53 | K | Relay (1.0) Calculated Property |
| Vc | 0.710 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [285.66; 632.48] | 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 | 6.76160e+01 | |||
| Coefficient B | 8.73560e-01 | |||
| Coefficient C | -2.61200e-04 | |||
| Coefficient D | -4.75000e-08 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 285.66 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 341.87 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 394.00 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 441.92 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 485.48 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 524.51 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 558.88 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 588.43 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 613.01 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 632.48 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0035153; 0.0001602] | Pa×s | [285.52; 507.17] |
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 | -1.27182e+01 | |||
| Coefficient B | 2.01792e+03 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 285.52 | |||
| Temperature range, max. | 507.17 | |||
| η | 0.0035153 | Pa×s | 285.52 | Calculated Property |
| η | 0.0020056 | Pa×s | 310.15 | Calculated Property |
| η | 0.0012427 | Pa×s | 334.77 | Calculated Property |
| η | 0.0008222 | Pa×s | 359.40 | Calculated Property |
| η | 0.0005736 | Pa×s | 384.03 | Calculated Property |
| η | 0.0004179 | Pa×s | 408.66 | Calculated Property |
| η | 0.0003156 | Pa×s | 433.28 | Calculated Property |
| η | 0.0002457 | Pa×s | 457.91 | Calculated Property |
| η | 0.0001962 | Pa×s | 482.54 | Calculated Property |
| η | 0.0001602 | Pa×s | 507.17 | Calculated Property |
Similar Compounds
Find more compounds similar to 2-Butoxyethyl isobutyl carbonate.
Sources
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