- InChI
- InChI=1S/C15H32/c1-5-6-7-8-9-10-11-12-15(4)13-14(2)3/h14-15H,5-13H2,1-4H3
- InChI Key
- JDFJCABQSZLDMZ-UHFFFAOYSA-N
- Formula
- C15H32
- SMILES
- CCCCCCCCCC(C)CC(C)C
- Molecular Weight1
- 212.41
- CAS
- 61868-05-1
- 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).
- ΔvapH : Enthalpy of vaporization at a given temperature (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).
- 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 | 0.6160 | Relay (1.0) Calculated Property | |
| ΔfG° | 70.54 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -370.45 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 27.56 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 68.10 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.64 | eV | Relay (1.0) Calculated Property |
| log10WS | -7.18 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.809 | Crippen Calculated Property | |
| McVol | 222.210 | ml/mol | McGowan Calculated Property |
| Pc | 1432.63 | kPa | Joback Calculated Property |
| Tboil | 518.26 | K | Relay (1.0) Calculated Property |
| Tc | 683.41 | K | Relay (1.0) Calculated Property |
| Tfus | 227.70 ± 2.00 | K | NIST |
| Vc | 0.853 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| ΔvapH | 57.90 | kJ/mol | 458.00 | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [323.06; 794.27] | 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 | -1.41110e+01 | |||
| Coefficient B | 1.44068e+00 | |||
| Coefficient C | -7.98600e-04 | |||
| Coefficient D | 1.66300e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 323.06 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 402.98 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 474.78 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 539.00 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 596.14 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 646.74 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 691.33 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 730.43 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 764.57 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 794.27 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0144369; 0.0002034] | Pa×s | [227.70; 494.59] |
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 | -1.21364e+01 | |||
| Coefficient B | 1.79848e+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. | 227.70 | |||
| Temperature range, max. | 494.59 | |||
| η | 0.0144369 | Pa×s | 227.70 | Calculated Property |
| η | 0.0058105 | Pa×s | 257.35 | Calculated Property |
| η | 0.0028225 | Pa×s | 287.01 | Calculated Property |
| η | 0.0015696 | Pa×s | 316.66 | Calculated Property |
| η | 0.0009651 | Pa×s | 346.32 | Calculated Property |
| η | 0.0006407 | Pa×s | 375.97 | Calculated Property |
| η | 0.0004517 | Pa×s | 405.63 | Calculated Property |
| η | 0.0003339 | Pa×s | 435.28 | Calculated Property |
| η | 0.0002565 | Pa×s | 464.93 | Calculated Property |
| η | 0.0002034 | Pa×s | 494.59 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.63] | kPa | [395.11; 556.57] |
The Yaws Handbook of Vapor Pressure
|
| Equation | ln(Y) = A + B/(T + C) Y is Pvap in kPa, T in K | |||
| Coefficient A | 1.41273e+01 | |||
| Coefficient B | -3.92129e+03 | |||
| Coefficient C | -1.11770e+02 | |||
| Temperature range, min. | 395.11 | |||
| Temperature range, max. | 556.57 | |||
| Pvap | 1.33 | kPa | 395.11 | Calculated Property |
| Pvap | 3.04 | kPa | 413.05 | Calculated Property |
| Pvap | 6.32 | kPa | 430.99 | Calculated Property |
| Pvap | 12.14 | kPa | 448.93 | Calculated Property |
| Pvap | 21.86 | kPa | 466.87 | Calculated Property |
| Pvap | 37.17 | kPa | 484.81 | Calculated Property |
| Pvap | 60.21 | kPa | 502.75 | Calculated Property |
| Pvap | 93.49 | kPa | 520.69 | Calculated Property |
| Pvap | 139.90 | kPa | 538.63 | Calculated Property |
| Pvap | 202.63 | kPa | 556.57 | Calculated Property |
Similar Compounds
Find more compounds similar to 2,4-Dimethyltridecane.
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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