- InChI
- InChI=1S/C14H28/c1-4-5-6-7-8-9-10-11-12-13-14(2)3/h2,4-13H2,1,3H3
- InChI Key
- VNBHQOHLCULRDN-UHFFFAOYSA-N
- Formula
- C14H28
- SMILES
- C=C(C)CCCCCCCCCCC
- Molecular Weight1
- 196.38
- CAS
- 18094-01-4
- Other Names
-
- 1-Tridecene, 2-methyl-
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- UQi : UNIQUAC Qi Parameter.
- URi : UNIQUAC Ri Parameter.
- Vc : Critical Volume (m3/kmol).
- Zc : Critical Compressibility.
- Zra : Rackett Parameter.
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ω | 0.6426 | ChemSep v8.3 pure component data Compiled value | |
| ΔfG° | 142.14 | kJ/mol | ChemSep v8.3 pure component data Compiled value |
| ΔfH°gas | -35.15 | kJ/mol | ChemSep v8.3 pure component data Compiled value |
| ΔfusH° | 29.43 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 68.35 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.18 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.64 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.483 | Crippen Calculated Property | |
| McVol | 203.820 | ml/mol | McGowan Calculated Property |
| Pc | 1530.10 | kPa | ChemSep v8.3 pure component data Compiled value |
| Inp | [1386.00; 1386.00] |
|
|
| Inp | 1386.00 | NIST | |
| Inp | 1386.00 | NIST | |
| Tboil | 523.15 | K | ChemSep v8.3 pure component data Compiled value |
| Tc | 688.62 | K | ChemSep v8.3 pure component data Compiled value |
| Tfus | 251.15 | K | Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) Compiled value |
| UQi | 8.08 | ChemSep v8.3 pure component data Compiled value | |
| URi | 9.66 | ChemSep v8.3 pure component data Compiled value | |
| Vc | 0.795 | m3/kmol | ChemSep v8.3 pure component data Compiled value |
| Zc | 0.2125000 | ChemSep v8.3 pure component data Compiled value | |
| Zra | 0.21 | ChemSep v8.3 pure component data Compiled value |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [296.06; 821.90] | J/mol×K | [206.59; 1500.00] |
ChemSep v8.3 pure component data Compiled value
|
| Equation | Y = A + exp(B/T + C + D·T + E·T²) Y is Cp,gas in J/mol×K, T in K | |||
| Coefficient A | 2.22670e+02 | |||
| Coefficient B | -4.60000e+02 | |||
| Coefficient C | 6.49224e+00 | |||
| Coefficient D | 1.47083e-04 | |||
| Coefficient E | -4.69555e-09 | |||
| Temperature range, min. | 206.59 | |||
| Temperature range, max. | 1500.00 | |||
| Cp,gas | 296.06 | J/mol×K | 206.59 | Calculated Property |
| Cp,gas | 409.47 | J/mol×K | 350.30 | Calculated Property |
| Cp,gas | 502.06 | J/mol×K | 494.01 | Calculated Property |
| Cp,gas | 574.38 | J/mol×K | 637.72 | Calculated Property |
| Cp,gas | 632.46 | J/mol×K | 781.44 | Calculated Property |
| Cp,gas | 680.77 | J/mol×K | 925.15 | Calculated Property |
| Cp,gas | 722.23 | J/mol×K | 1068.86 | Calculated Property |
| Cp,gas | 758.78 | J/mol×K | 1212.57 | Calculated Property |
| Cp,gas | 791.70 | J/mol×K | 1356.29 | Calculated Property |
| Cp,gas | 821.90 | J/mol×K | 1500.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.67] | kPa | [393.30; 545.80] |
The Yaws Handbook of Vapor Pressure
|
| Equation | ln(Y) = A + B/(T + C) Y is Pvap in kPa, T in K | |||
| Coefficient A | 1.55791e+01 | |||
| Coefficient B | -4.76568e+03 | |||
| Coefficient C | -8.16500e+01 | |||
| Temperature range, min. | 393.30 | |||
| Temperature range, max. | 545.80 | |||
| Pvap | 1.33 | kPa | 393.30 | Calculated Property |
| Pvap | 2.93 | kPa | 410.24 | Calculated Property |
| Pvap | 5.97 | kPa | 427.19 | Calculated Property |
| Pvap | 11.38 | kPa | 444.13 | Calculated Property |
| Pvap | 20.47 | kPa | 461.08 | Calculated Property |
| Pvap | 35.02 | kPa | 478.02 | Calculated Property |
| Pvap | 57.33 | kPa | 494.97 | Calculated Property |
| Pvap | 90.28 | kPa | 511.91 | Calculated Property |
| Pvap | 137.35 | kPa | 528.86 | Calculated Property |
| Pvap | 202.67 | kPa | 545.80 | Calculated Property |
Similar Compounds
Find more compounds similar to 2-Methyl-1-tridecene.
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)
- ChemSep v8.3 pure component data Converted from ChemSep v8.3 pure component data, H. Kooijman and R. Taylor (2021, 2022), Artistic License 2.0; see how the values differ.
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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