- InChI
- InChI=1S/C14H30/c1-4-5-6-7-8-9-10-11-12-13-14(2)3/h14H,4-13H2,1-3H3
- InChI Key
- CJBFZKZYIPBBTO-UHFFFAOYSA-N
- Formula
- C14H30
- SMILES
- CCCCCCCCCCCC(C)C
- Molecular Weight1
- 198.39
- CAS
- 1560-96-9
- Other Names
-
- 2-Methyl-n-tridecane
- 2-Methyltridecane
- 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).
- 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 | 0.6193 | Relay (1.0) Calculated Property | |
| ΔfG° | 64.56 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -346.39 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 28.49 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 68.81 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.73 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.98 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.563 | Crippen Calculated Property | |
| McVol | 208.120 | ml/mol | McGowan Calculated Property |
| Pc | 1533.06 | kPa | Joback Calculated Property |
| Inp | [1360.00; 1366.00] |
|
|
| Inp | 1364.00 | NIST | |
| Inp | 1364.94 | NIST | |
| Inp | 1365.01 | NIST | |
| Inp | 1365.08 | NIST | |
| Inp | 1364.21 | NIST | |
| Inp | 1364.21 | NIST | |
| Inp | 1364.21 | NIST | |
| Inp | 1365.00 | NIST | |
| Inp | 1365.00 | NIST | |
| Inp | 1364.00 | NIST | |
| Inp | Outlier 1360.00 | NIST | |
| Inp | 1365.40 | NIST | |
| Inp | 1366.00 | NIST | |
| Inp | 1365.00 | NIST | |
| Inp | 1366.00 | NIST | |
| Inp | Outlier 1361.00 | NIST | |
| Inp | 1362.00 | NIST | |
| Inp | 1365.00 | NIST | |
| Inp | 1364.00 | NIST | |
| Tboil | 513.55 | K | Relay (1.0) Calculated Property |
| Tc | 677.06 | K | Relay (1.0) Calculated Property |
| Tfus | [247.30; 251.00] | K |
|
| Tfus | 248.15 | K | Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) Compiled value |
| Tfus | 247.30 ± 2.00 | K | NIST |
| Tfus | 251.00 ± 4.00 | K | NIST |
| Vc | 0.829 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| ΔvapH | 56.30 | kJ/mol | 459.00 | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [302.16; 742.14] | 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 | -1.15200e+01 | |||
| Coefficient B | 1.33976e+00 | |||
| Coefficient C | -7.41000e-04 | |||
| Coefficient D | 1.54900e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 302.16 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 376.57 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 443.46 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 503.32 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 556.62 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 603.88 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 645.57 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 682.18 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 714.21 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 742.14 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0056616; 0.0002292] | Pa×s | [248.82; 477.42] |
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 | -1.18717e+01 | |||
| Coefficient B | 1.66650e+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. | 248.82 | |||
| Temperature range, max. | 477.42 | |||
| η | 0.0056616 | Pa×s | 248.82 | Calculated Property |
| η | 0.0030445 | Pa×s | 274.22 | Calculated Property |
| η | 0.0018187 | Pa×s | 299.62 | Calculated Property |
| η | 0.0011776 | Pa×s | 325.02 | Calculated Property |
| η | 0.0008120 | Pa×s | 350.42 | Calculated Property |
| η | 0.0005888 | Pa×s | 375.82 | Calculated Property |
| η | 0.0004447 | Pa×s | 401.22 | Calculated Property |
| η | 0.0003473 | Pa×s | 426.62 | Calculated Property |
| η | 0.0002788 | Pa×s | 452.02 | Calculated Property |
| η | 0.0002292 | Pa×s | 477.42 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.64] | kPa | [392.23; 553.24] |
The Yaws Handbook of Vapor Pressure
|
| Equation | ln(Y) = A + B/(T + C) Y is Pvap in kPa, T in K | |||
| Coefficient A | 1.42606e+01 | |||
| Coefficient B | -4.00753e+03 | |||
| Coefficient C | -1.05430e+02 | |||
| Temperature range, min. | 392.23 | |||
| Temperature range, max. | 553.24 | |||
| Pvap | 1.33 | kPa | 392.23 | Calculated Property |
| Pvap | 3.03 | kPa | 410.12 | Calculated Property |
| Pvap | 6.28 | kPa | 428.01 | Calculated Property |
| Pvap | 12.06 | kPa | 445.90 | Calculated Property |
| Pvap | 21.71 | kPa | 463.79 | Calculated Property |
| Pvap | 36.94 | kPa | 481.68 | Calculated Property |
| Pvap | 59.91 | kPa | 499.57 | Calculated Property |
| Pvap | 93.16 | kPa | 517.46 | Calculated Property |
| Pvap | 139.64 | kPa | 535.35 | Calculated Property |
| Pvap | 202.64 | kPa | 553.24 | Calculated Property |
Similar Compounds
Find more compounds similar to Tridecane, 2-methyl-.
Sources
- Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) ChEDL chemicals 1.5.2, from Bradley, J.-C.; Williams, A.; Lang, A. Jean-Claude Bradley Open Melting Point Dataset. Figshare, 2014 (CC0).
- Cheméo Relay (1.0)
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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