- InChI
- InChI=1S/C14H27N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h2-13H2,1H3
- InChI Key
- MLRCLPRHEOPXLL-UHFFFAOYSA-N
- Formula
- C14H27N
- SMILES
- CCCCCCCCCCCCCC#N
- Molecular Weight1
- 209.37
- CAS
- 629-63-0
- Other Names
-
- 1-Cyanotridecane
- 1-tridecanecarbonitrile
- Myristonitrile
- Myristyl nitrile
- Tetradecanonitrile
- tridecyl cyanide
- ΔcH°liquid : Standard liquid enthalpy of combustion (kJ/mol).
- 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).
- ΔfH°liquid : Liquid phase 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).
- 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).
- Tboilr : Boiling point at reduced pressure (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 |
|---|---|---|---|
| ΔcH°liquid | -9107.70 ± 1.80 | kJ/mol | NIST |
| ΔfG° | 200.18 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -174.80 ± 2.70 | kJ/mol | NIST |
| ΔfH°liquid | -260.10 ± 2.60 | kJ/mol | NIST |
| ΔfusH° | 33.52 | kJ/mol | Joback Calculated Property |
| ΔvapH° | [84.20; 85.30] | kJ/mol |
|
| ΔvapH° | 85.29 | kJ/mol | NIST |
| ΔvapH° | 84.20 ± 0.20 | kJ/mol | NIST |
| ΔvapH° | 85.29 ± 0.51 | kJ/mol | NIST |
| ΔvapH° | 85.30 | kJ/mol | NIST |
| ΔvapH° | 85.30 ± 0.50 | kJ/mol | NIST |
| log10WS | -5.55 | Crippen Calculated Property | |
| logPoct/wat | 5.211 | Crippen Calculated Property | |
| McVol | 209.500 | ml/mol | McGowan Calculated Property |
| Pc | 1494.19 | kPa | Joback Calculated Property |
| Inp | [285.95; 1698.00] |
|
|
| Inp | 1695.00 | NIST | |
| Inp | 1698.00 | NIST | |
| Inp | 285.95 | NIST | |
| Inp | 1695.00 | NIST | |
| Tboil | 621.80 | K | Joback Calculated Property |
| Tc | 797.24 | K | Joback Calculated Property |
| Tfus | [292.15; 292.40] | K |
|
| Tfus | 292.40 ± 0.30 | K | NIST |
| Tfus | 292.40 ± 0.30 | K | NIST |
| Tfus | 292.15 ± 1.00 | K | NIST |
| Tfus | 292.35 ± 1.00 | K | NIST |
| Tfus | 292.20 ± 2.00 | K | NIST |
| Vc | 0.846 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [558.56; 644.87] | J/mol×K | [621.80; 797.24] |
|
| Cp,gas | 558.56 | J/mol×K | 621.80 | Joback Calculated Property |
| Cp,gas | 574.65 | J/mol×K | 651.04 | Joback Calculated Property |
| Cp,gas | 590.02 | J/mol×K | 680.28 | Joback Calculated Property |
| Cp,gas | 604.71 | J/mol×K | 709.52 | Joback Calculated Property |
| Cp,gas | 618.74 | J/mol×K | 738.76 | Joback Calculated Property |
| Cp,gas | 632.11 | J/mol×K | 768.00 | Joback Calculated Property |
| Cp,gas | 644.87 | J/mol×K | 797.24 | Joback Calculated Property |
| ΔvapH | 71.40 | kJ/mol | 485.50 | NIST |
| Pvap | [1.09e-03; 0.03] | kPa | [327.20; 369.20] |
|
| Pvap | 1.09e-03 | kPa | 327.20 | Vapor P... |
| Pvap | 1.39e-03 | kPa | 330.20 | Vapor P... |
| Pvap | 1.83e-03 | kPa | 333.20 | Vapor P... |
| Pvap | 2.36e-03 | kPa | 336.20 | Vapor P... |
| Pvap | 3.06e-03 | kPa | 339.20 | Vapor P... |
| Pvap | 3.83e-03 | kPa | 342.10 | Vapor P... |
| Pvap | 4.91e-03 | kPa | 345.20 | Vapor P... |
| Pvap | 6.28e-03 | kPa | 348.10 | Vapor P... |
| Pvap | 7.77e-03 | kPa | 351.20 | Vapor P... |
| Pvap | 9.82e-03 | kPa | 354.20 | Vapor P... |
| Pvap | 0.01 | kPa | 357.20 | Vapor P... |
| Pvap | 0.01 | kPa | 360.20 | Vapor P... |
| Pvap | 0.02 | kPa | 363.20 | Vapor P... |
| Pvap | 0.02 | kPa | 366.20 | Vapor P... |
| Pvap | 0.03 | kPa | 369.20 | Vapor P... |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 499.70 | K | 13.30 | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.63] | kPa | [438.42; 623.79] |
The Yaw...
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.44096e+01 | |||
| Coefficient B | -4.74091e+03 | |||
| Coefficient C | -1.02710e+02 | |||
| Temperature range, min. | 438.42 | |||
| Temperature range, max. | 623.79 | |||
| Pvap | 1.33 | kPa | 438.42 | Calculated Property |
| Pvap | 3.02 | kPa | 459.02 | Calculated Property |
| Pvap | 6.24 | kPa | 479.61 | Calculated Property |
| Pvap | 11.97 | kPa | 500.21 | Calculated Property |
| Pvap | 21.55 | kPa | 520.81 | Calculated Property |
| Pvap | 36.70 | kPa | 541.40 | Calculated Property |
| Pvap | 59.58 | kPa | 562.00 | Calculated Property |
| Pvap | 92.80 | kPa | 582.60 | Calculated Property |
| Pvap | 139.35 | kPa | 603.19 | Calculated Property |
| Pvap | 202.63 | kPa | 623.79 | Calculated Property |
Similar Compounds
Find more compounds similar to Tetradecanenitrile.
Mixtures
Sources
- Crippen Method
- Crippen Method
- Vapor Pressures and Enthalpies of Vaporization of a Series of the Linear Aliphatic Nitriles.
- Excess Enthalpies of {CH3(CH2)nCN, n = 5 to 12} + Methyl Methylthiomethyl Sulfoxide or + Dimethyl Sulfoxide at 298.15 K
- Joback Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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