- InChI
- InChI=1S/C11H22O/c1-3-5-6-7-8-9-11-12-10-4-2/h4H,2-3,5-11H2,1H3
- InChI Key
- IELYMBBIHQDONA-UHFFFAOYSA-N
- Formula
- C11H22O
- SMILES
- C=CCOCCCCCCCC
- Molecular Weight1
- 170.30
- 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).
- 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 | 0.5582 | Relay (1.0) Calculated Property | |
| ΔfG° | 24.58 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -283.55 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 24.15 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 56.89 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.41 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.94 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.550 | Crippen Calculated Property | |
| McVol | 167.420 | ml/mol | McGowan Calculated Property |
| Pc | 1977.07 | kPa | Joback Calculated Property |
| Tboil | 479.20 ± 1.00 | K | NIST |
| Tc | 659.16 | K | Relay (1.0) Calculated Property |
| Tfus | 212.20 ± 1.00 | K | NIST |
| Vc | 0.630 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [244.43; 576.82] | 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 | 1.53980e+01 | |||
| Coefficient B | 9.65620e-01 | |||
| Coefficient C | -4.86500e-04 | |||
| Coefficient D | 8.23000e-08 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 244.43 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 299.77 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 349.90 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 395.08 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 435.57 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 471.64 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 503.53 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 531.52 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 555.86 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 576.82 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0072253; 0.0002279] | Pa×s | [212.20; 444.64] |
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 | -1.15425e+01 | |||
| Coefficient B | 1.40313e+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. | 212.20 | |||
| Temperature range, max. | 444.64 | |||
| η | 0.0072253 | Pa×s | 212.20 | Calculated Property |
| η | 0.0035259 | Pa×s | 238.03 | Calculated Property |
| η | 0.0019801 | Pa×s | 263.85 | Calculated Property |
| η | 0.0012325 | Pa×s | 289.68 | Calculated Property |
| η | 0.0008290 | Pa×s | 315.51 | Calculated Property |
| η | 0.0005922 | Pa×s | 341.33 | Calculated Property |
| η | 0.0004435 | Pa×s | 367.16 | Calculated Property |
| η | 0.0003450 | Pa×s | 392.99 | Calculated Property |
| η | 0.0002768 | Pa×s | 418.81 | Calculated Property |
| η | 0.0002279 | Pa×s | 444.64 | Calculated Property |
Similar Compounds
Find more compounds similar to ALLYL OCTYL ETHER.
Sources
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