- InChI
- InChI=1S/C24H50O/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-25-23-24(2)3/h24H,4-23H2,1-3H3
- InChI Key
- GOCHXPOMSUKLRG-UHFFFAOYSA-N
- Formula
- C24H50O
- SMILES
- CCCCCCCCCCCCCCCCCCCCOCC(C)C
- Molecular Weight1
- 354.66
- 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 | 1.0372 | Relay (1.0) Calculated Property | |
| ΔfG° | 43.76 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -673.74 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 55.58 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 115.19 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.67 | eV | Relay (1.0) Calculated Property |
| log10WS | -8.77 | Relay (1.0) Calculated Property | |
| logPoct/wat | 8.701 | Crippen Calculated Property | |
| McVol | 354.890 | ml/mol | McGowan Calculated Property |
| Pc | 802.06 | kPa | Joback Calculated Property |
| Inp | 2426.00 | NIST | |
| Tboil | 613.21 | K | Relay (1.0) Calculated Property |
| Tc | 791.64 | K | Relay (1.0) Calculated Property |
| Tfus | 284.53 | K | Relay (1.0) Calculated Property |
| Vc | 1.398 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [529.70; 1276.55] | 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 | 4.89000e+00 | |||
| Coefficient B | 2.22656e+00 | |||
| Coefficient C | -1.17400e-03 | |||
| Coefficient D | 2.19100e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 529.70 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 655.36 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 768.74 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 870.52 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 961.40 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 1042.07 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 1113.23 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 1175.57 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 1229.78 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 1276.55 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0019554; 0.0000721] | Pa×s | [367.47; 661.17] |
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 | -1.36668e+01 | |||
| Coefficient B | 2.73019e+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. | 367.47 | |||
| Temperature range, max. | 661.17 | |||
| η | 0.0019554 | Pa×s | 367.47 | Calculated Property |
| η | 0.0010668 | Pa×s | 400.10 | Calculated Property |
| η | 0.0006377 | Pa×s | 432.74 | Calculated Property |
| η | 0.0004097 | Pa×s | 465.37 | Calculated Property |
| η | 0.0002789 | Pa×s | 498.00 | Calculated Property |
| η | 0.0001991 | Pa×s | 530.64 | Calculated Property |
| η | 0.0001478 | Pa×s | 563.27 | Calculated Property |
| η | 0.0001133 | Pa×s | 595.90 | Calculated Property |
| η | 0.0000893 | Pa×s | 628.53 | Calculated Property |
| η | 0.0000721 | Pa×s | 661.17 | Calculated Property |
Similar Compounds
Find more compounds similar to Eicosyl isobutyl ether.
Sources
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