- InChI
- InChI=1S/C14H28O/c1-3-14(2)12-10-8-6-4-5-7-9-11-13-15/h6,8,14-15H,3-5,7,9-13H2,1-2H3/b8-6+
- InChI Key
- OSKGVVRBLOSNPX-SOFGYWHQSA-N
- Formula
- C14H28O
- SMILES
- CCC(C)CC/C=C/CCCCCCO
- Molecular Weight1
- 212.38
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Pvap : Vapor pressure (kPa).
- Ip : 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 | 0.7863 | Relay (1.0) Calculated Property | |
| ΔfusH° | 32.78 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 96.45 | kJ/mol | Relay (1.0) Calculated Property |
| logPoct/wat | 4.312 | Crippen Calculated Property | |
| McVol | 209.690 | ml/mol | McGowan Calculated Property |
| Pc | 1721.73 | kPa | Joback Calculated Property |
| Ip | [2210.00; 2210.00] |
|
|
| Ip | 2210.00 | NIST | |
| Ip | 2210.00 | NIST | |
| Tboil | 562.27 | K | Relay (1.0) Calculated Property |
| Tc | 743.07 | K | Relay (1.0) Calculated Property |
| Tfus | 254.78 | K | Relay (1.0) Calculated Property |
| Vc | 0.747 | m3/kmol | Relay (1.0) Calculated Property |
Cheméo can also estimate Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [300.66; 730.23] | 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 | -2.04110e+01 | |||
| Coefficient B | 1.39374e+00 | |||
| Coefficient C | -8.55200e-04 | |||
| Coefficient D | 2.12100e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 300.66 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 375.02 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 441.16 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 499.74 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 551.45 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 596.94 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 636.90 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 671.98 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 702.87 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 730.23 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0232089; 0.0000937] | Pa×s | [288.28; 546.62] |
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 | -1.54266e+01 | |||
| Coefficient B | 3.36233e+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. | 288.28 | |||
| Temperature range, max. | 546.62 | |||
| η | 0.0232089 | Pa×s | 288.28 | Calculated Property |
| η | 0.0080716 | Pa×s | 316.98 | Calculated Property |
| η | 0.0033454 | Pa×s | 345.69 | Calculated Property |
| η | 0.0015870 | Pa×s | 374.39 | Calculated Property |
| η | 0.0008372 | Pa×s | 403.10 | Calculated Property |
| η | 0.0004809 | Pa×s | 431.80 | Calculated Property |
| η | 0.0002960 | Pa×s | 460.51 | Calculated Property |
| η | 0.0001928 | Pa×s | 489.21 | Calculated Property |
| η | 0.0001317 | Pa×s | 517.92 | Calculated Property |
| η | 0.0000937 | Pa×s | 546.62 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.63] | kPa | [433.72; 630.09] |
The Yaws Handbook of Vapor Pressure
|
| Equation | ln(Y) = A + B/(T + C) Y is Pvap in kPa, T in K | |||
| Coefficient A | 1.39149e+01 | |||
| Coefficient B | -4.58276e+03 | |||
| Coefficient C | -9.74280e+01 | |||
| Temperature range, min. | 433.72 | |||
| Temperature range, max. | 630.09 | |||
| Pvap | 1.33 | kPa | 433.72 | Calculated Property |
| Pvap | 3.06 | kPa | 455.54 | Calculated Property |
| Pvap | 6.38 | kPa | 477.36 | Calculated Property |
| Pvap | 12.28 | kPa | 499.18 | Calculated Property |
| Pvap | 22.10 | kPa | 521.00 | Calculated Property |
| Pvap | 37.54 | kPa | 542.81 | Calculated Property |
| Pvap | 60.71 | kPa | 564.63 | Calculated Property |
| Pvap | 94.04 | kPa | 586.45 | Calculated Property |
| Pvap | 140.32 | kPa | 608.27 | Calculated Property |
| Pvap | 202.63 | kPa | 630.09 | Calculated Property |
Similar Compounds
Find more compounds similar to 11-methyl-7-tridecen-1-ol.
Sources
- Cheméo Relay (1.0)
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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