- InChI
- InChI=1S/C15H30O2/c1-14(2)12-10-8-6-4-3-5-7-9-11-13-15(16)17/h14H,3-13H2,1-2H3,(H,16,17)
- InChI Key
- ZOCYQVNGROEVLU-UHFFFAOYSA-N
- Formula
- C15H30O2
- SMILES
- CC(C)CCCCCCCCCCCC(=O)O
- Molecular Weight1
- 242.40
- CAS
- 2485-71-4
- 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).
- Pvap : Vapor pressure (kPa).
- I : 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 | 0.9688 | Relay (1.0) Calculated Property | |
| ΔfG° | -192.76 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -723.84 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 36.77 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 109.48 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.91 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.20 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.018 | Crippen Calculated Property | |
| McVol | 229.650 | ml/mol | McGowan Calculated Property |
| Pc | 1606.42 | kPa | Joback Calculated Property |
| I | 2776.00 | NIST | |
| Tboil | 581.61 | K | Relay (1.0) Calculated Property |
| Tc | 770.45 | K | Relay (1.0) Calculated Property |
| Tfus | 335.52 | K | Relay (1.0) Calculated Property |
| Vc | 0.865 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [664.10; 747.69] | J/mol×K | [688.21; 857.15] | 
|
| Cp,gas | 664.10 | J/mol×K | 688.21 | Joback Calculated Property |
| Cp,gas | 679.73 | J/mol×K | 716.37 | Joback Calculated Property |
| Cp,gas | 694.65 | J/mol×K | 744.52 | Joback Calculated Property |
| Cp,gas | 708.88 | J/mol×K | 772.68 | Joback Calculated Property |
| Cp,gas | 722.45 | J/mol×K | 800.84 | Joback Calculated Property |
| Cp,gas | 735.38 | J/mol×K | 828.99 | Joback Calculated Property |
| Cp,gas | 747.69 | J/mol×K | 857.15 | Joback Calculated Property |
| η | [0.0000393; 0.0064199] | Pa×s | [354.56; 688.21] |
|
| η | 0.0064199 | Pa×s | 354.56 | Joback Calculated Property |
| η | 0.0015442 | Pa×s | 410.17 | Joback Calculated Property |
| η | 0.0005220 | Pa×s | 465.78 | Joback Calculated Property |
| η | 0.0002224 | Pa×s | 521.38 | Joback Calculated Property |
| η | 0.0001117 | Pa×s | 576.99 | Joback Calculated Property |
| η | 0.0000633 | Pa×s | 632.60 | Joback Calculated Property |
| η | 0.0000393 | Pa×s | 688.21 | Joback Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.64] | kPa | [470.52; 638.98] |
The Yaws Handbook of Vapor Pressure
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.60357e+01 | |||
| Coefficient B | -5.66316e+03 | |||
| Coefficient C | -1.10911e+02 | |||
| Temperature range, min. | 470.52 | |||
| Temperature range, max. | 638.98 | |||
| Pvap | 1.33 | kPa | 470.52 | Calculated Property |
| Pvap | 2.91 | kPa | 489.24 | Calculated Property |
| Pvap | 5.88 | kPa | 507.96 | Calculated Property |
| Pvap | 11.18 | kPa | 526.67 | Calculated Property |
| Pvap | 20.11 | kPa | 545.39 | Calculated Property |
| Pvap | 34.46 | kPa | 564.11 | Calculated Property |
| Pvap | 56.56 | kPa | 582.83 | Calculated Property |
| Pvap | 89.40 | kPa | 601.54 | Calculated Property |
| Pvap | 136.63 | kPa | 620.26 | Calculated Property |
| Pvap | 202.64 | kPa | 638.98 | Calculated Property |
Similar Compounds
Find more compounds similar to 13-methyltetradecanoic acid.
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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