- InChI
- InChI=1S/C17H36/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17(2)3/h17H,4-16H2,1-3H3
- InChI Key
- FNWWOHKUXFTKGN-UHFFFAOYSA-N
- Formula
- C17H36
- SMILES
- CCCCCCCCCCCCCCC(C)C
- Molecular Weight1
- 240.47
- CAS
- 1560-92-5
- Other Names
-
- 2-Methylhexadecane
- 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).
- 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.
- I : 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 |
|---|---|---|---|
| ΔfG° | 89.82 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -399.49 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 36.26 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 53.05 | kJ/mol | Joback Calculated Property |
| log10WS | -6.70 | Crippen Calculated Property | |
| logPoct/wat | 6.734 | Crippen Calculated Property | |
| McVol | 250.390 | ml/mol | McGowan Calculated Property |
| Pc | 1238.09 | kPa | Joback Calculated Property |
| Inp | [1659.00; 1671.00] |
|
|
| Inp | 1665.00 | NIST | |
| Inp | 1660.60 | NIST | |
| Inp | 1663.80 | NIST | |
| Inp | 1664.00 | NIST | |
| Inp | 1664.72 | NIST | |
| Inp | 1664.77 | NIST | |
| Inp | 1664.63 | NIST | |
| Inp | 1663.61 | NIST | |
| Inp | 1663.85 | NIST | |
| Inp | 1664.11 | NIST | |
| Inp | 1666.00 | NIST | |
| Inp | 1665.00 | NIST | |
| Inp | 1665.40 | NIST | |
| Inp | Outlier 1671.00 | NIST | |
| Inp | Outlier 1659.00 | NIST | |
| Inp | 1664.00 | NIST | |
| Inp | 1663.85 | NIST | |
| Inp | Outlier 1659.00 | NIST | |
| Inp | 1666.00 | NIST | |
| I | [1654.00; 1661.70] |
|
|
| I | 1661.70 | NIST | |
| I | 1654.00 | NIST | |
| I | 1654.00 | NIST | |
| Tboil | 587.92 | K | Joback Calculated Property |
| Tc | 748.86 | K | Joback Calculated Property |
| Tfus | 278.10 ± 6.00 | K | NIST |
| Vc | 0.982 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [667.18; 775.45] | J/mol×K | [587.92; 748.86] |
|
| Cp,gas | 667.18 | J/mol×K | 587.92 | Joback Calculated Property |
| Cp,gas | 687.14 | J/mol×K | 614.74 | Joback Calculated Property |
| Cp,gas | 706.30 | J/mol×K | 641.57 | Joback Calculated Property |
| Cp,gas | 724.69 | J/mol×K | 668.39 | Joback Calculated Property |
| Cp,gas | 742.33 | J/mol×K | 695.21 | Joback Calculated Property |
| Cp,gas | 759.24 | J/mol×K | 722.04 | Joback Calculated Property |
| Cp,gas | 775.45 | J/mol×K | 748.86 | Joback Calculated Property |
| η | [0.0001283; 0.0070198] | Pa×s | [266.35; 587.92] |
|
| η | 0.0070198 | Pa×s | 266.35 | Joback Calculated Property |
| η | 0.0020606 | Pa×s | 319.94 | Joback Calculated Property |
| η | 0.0008598 | Pa×s | 373.54 | Joback Calculated Property |
| η | 0.0004468 | Pa×s | 427.13 | Joback Calculated Property |
| η | 0.0002686 | Pa×s | 480.73 | Joback Calculated Property |
| η | 0.0001789 | Pa×s | 534.33 | Joback Calculated Property |
| η | 0.0001283 | Pa×s | 587.92 | Joback Calculated Property |
| ΔvapH | 63.50 | kJ/mol | 498.50 | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.66] | kPa | [432.02; 604.65] |
The Yaw...
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.42770e+01 | |||
| Coefficient B | -4.30973e+03 | |||
| Coefficient C | -1.23950e+02 | |||
| Temperature range, min. | 432.02 | |||
| Temperature range, max. | 604.65 | |||
| Pvap | 1.33 | kPa | 432.02 | Calculated Property |
| Pvap | 3.03 | kPa | 451.20 | Calculated Property |
| Pvap | 6.28 | kPa | 470.38 | Calculated Property |
| Pvap | 12.05 | kPa | 489.56 | Calculated Property |
| Pvap | 21.69 | kPa | 508.74 | Calculated Property |
| Pvap | 36.92 | kPa | 527.93 | Calculated Property |
| Pvap | 59.88 | kPa | 547.11 | Calculated Property |
| Pvap | 93.13 | kPa | 566.29 | Calculated Property |
| Pvap | 139.62 | kPa | 585.47 | Calculated Property |
| Pvap | 202.66 | kPa | 604.65 | Calculated Property |
Similar Compounds
Find more compounds similar to Hexadecane, 2-methyl-.
Sources
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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