- InChI
- InChI=1S/C42H86/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-42H2,1-2H3
- InChI Key
- FTJPDYTXORWVLU-UHFFFAOYSA-N
- Formula
- C42H86
- SMILES
-
CCCCCCCCCCCCCCCCCCCCCCCCCCCCCC
CCCCCCCCCCCC - Molecular Weight1
- 591.13
- CAS
- 7098-20-6
- Other Names
-
- n-Dotetracontane
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- Cp,liquid : Liquid phase 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).
- ΔfusH : Enthalpy of fusion at a given temperature (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).
- 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 |
|---|---|---|---|
| ΔfG° | 302.76 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -910.21 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 165.97 | kJ/mol | Observa... |
| ΔvapH° | 213.50 | kJ/mol | NIST |
| log10WS | -17.40 | Crippen Calculated Property | |
| logPoct/wat | 16.630 | Crippen Calculated Property | |
| McVol | 602.640 | ml/mol | McGowan Calculated Property |
| Pc | 362.81 | kPa | Joback Calculated Property |
| Tboil | 1160.36 | K | Joback Calculated Property |
| Tc | 1598.77 | K | Joback Calculated Property |
| Tfus | [356.10; 356.10] | K |
|
| Tfus | 356.10 ± 2.00 | K | NIST |
| Tfus | 356.10 ± 4.00 | K | NIST |
| Vc | 2.388 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [2318.08; 2567.37] | J/mol×K | [1160.36; 1598.77] |
|
|
T(K) Ideal gas heat capacity (J/mol×K) 2300 2350 2400 2450 2500 2550 1200 1400 1600 | ||||
| Cp,gas | 2318.08 | J/mol×K | 1160.36 | Joback Calculated Property |
| Cp,gas | 2367.91 | J/mol×K | 1233.43 | Joback Calculated Property |
| Cp,gas | 2412.90 | J/mol×K | 1306.50 | Joback Calculated Property |
| Cp,gas | 2454.20 | J/mol×K | 1379.56 | Joback Calculated Property |
| Cp,gas | 2492.95 | J/mol×K | 1452.63 | Joback Calculated Property |
| Cp,gas | 2530.29 | J/mol×K | 1525.70 | Joback Calculated Property |
| Cp,gas | 2567.37 | J/mol×K | 1598.77 | Joback Calculated Property |
| Cp,liquid | 1425.00 | J/mol×K | 353.00 | NIST |
| η | [0.0000036; 0.0001763] | Pa×s | [563.10; 1160.36] |
|
|
T(K) Dynamic viscosity (Pa×s) 0 5.00e-5 1.00e-4 1.50e-4 600 800 1000 | ||||
| η | 0.0001763 | Pa×s | 563.10 | Joback Calculated Property |
| η | 0.0000565 | Pa×s | 662.64 | Joback Calculated Property |
| η | 0.0000244 | Pa×s | 762.19 | Joback Calculated Property |
| η | 0.0000128 | Pa×s | 861.73 | Joback Calculated Property |
| η | 0.0000076 | Pa×s | 961.27 | Joback Calculated Property |
| η | 0.0000050 | Pa×s | 1060.82 | Joback Calculated Property |
| η | 0.0000036 | Pa×s | 1160.36 | Joback Calculated Property |
| ΔfusH | 165.97 | kJ/mol | 357.30 | NIST |
| ΔvapH | [136.00; 213.50] | kJ/mol | [298.15; 688.50] |
|
| ΔvapH | 213.50 | kJ/mol | 298.15 | Hypothe... |
| ΔvapH | 136.00 | kJ/mol | 688.50 | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.64] | kPa | [636.54; 862.28] |
The Yaw...
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.41329e+01 | |||
| Coefficient B | -5.48809e+03 | |||
| Coefficient C | -2.40150e+02 | |||
| Temperature range, min. | 636.54 | |||
| Temperature range, max. | 862.28 | |||
|
T(K) Vapor pressure (kPa) 0 50 100 150 200 700 800 | ||||
| Pvap | 1.33 | kPa | 636.54 | Calculated Property |
| Pvap | 3.04 | kPa | 661.62 | Calculated Property |
| Pvap | 6.32 | kPa | 686.70 | Calculated Property |
| Pvap | 12.14 | kPa | 711.79 | Calculated Property |
| Pvap | 21.85 | kPa | 736.87 | Calculated Property |
| Pvap | 37.16 | kPa | 761.95 | Calculated Property |
| Pvap | 60.20 | kPa | 787.03 | Calculated Property |
| Pvap | 93.48 | kPa | 812.12 | Calculated Property |
| Pvap | 139.89 | kPa | 837.20 | Calculated Property |
| Pvap | 202.64 | kPa | 862.28 | Calculated Property |
Similar Compounds
Find more compounds similar to Dotetracontane.
Sources
- Crippen Method
- Crippen Method
- Observation of multiple phase transitions in some even n-alkanes using a high resolution and super-sensitive DSC
- Hypothetical Thermodynamic Properties: Vapor Pressures and Vaporization Enthalpies of the Even n-Alkanes from C40 to C76 at T = 298.15 K by Correlation-Gas Chromatography. Are the Vaporization Enthalpies a Linear Function of Carbon Number?
- Joback Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.