- InChI
- InChI=1S/C19H40/c1-4-7-9-11-12-14-16-18-19(6-3)17-15-13-10-8-5-2/h19H,4-18H2,1-3H3
- InChI Key
- PFHNDLOOIBCYQP-UHFFFAOYSA-N
- Formula
- C19H40
- SMILES
- CCCCCCCCCC(CC)CCCCCCC
- Molecular Weight1
- 268.52
- 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).
- 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).
- 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 | 0.7723 | Relay (1.0) Calculated Property | |
| ΔfG° | 106.66 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -435.03 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 41.44 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 92.01 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.58 | eV | Relay (1.0) Calculated Property |
| log10WS | -8.22 | Relay (1.0) Calculated Property | |
| logPoct/wat | 7.514 | Crippen Calculated Property | |
| McVol | 278.570 | ml/mol | McGowan Calculated Property |
| Pc | 1086.35 | kPa | Joback Calculated Property |
| Inp | [1714.00; 1727.00] |
|
|
| Inp | 1714.00 | NIST | |
| Inp | 1714.00 | NIST | |
| Inp | 1727.00 | NIST | |
| Inp | 1727.00 | NIST | |
| Tboil | 572.35 | K | Relay (1.0) Calculated Property |
| Tc | 740.36 | K | Relay (1.0) Calculated Property |
| Tfus | 246.68 | K | Relay (1.0) Calculated Property |
| Vc | 1.080 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [408.23; 1000.09] | 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 | -1.60650e+01 | |||
| Coefficient B | 1.81476e+00 | |||
| Coefficient C | -1.01300e-03 | |||
| Coefficient D | 2.14400e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 408.23 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 508.66 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 598.85 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 679.46 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 751.18 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 814.68 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 870.65 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 919.75 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 962.68 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 1000.09 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0057089; 0.0001626] | Pa×s | [288.89; 556.65] |
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 | -1.25640e+01 | |||
| Coefficient B | 2.13730e+03 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 288.89 | |||
| Temperature range, max. | 556.65 | |||
| η | 0.0057089 | Pa×s | 288.89 | Calculated Property |
| η | 0.0028613 | Pa×s | 318.64 | Calculated Property |
| η | 0.0016136 | Pa×s | 348.39 | Calculated Property |
| η | 0.0009958 | Pa×s | 378.14 | Calculated Property |
| η | 0.0006594 | Pa×s | 407.89 | Calculated Property |
| η | 0.0004618 | Pa×s | 437.64 | Calculated Property |
| η | 0.0003384 | Pa×s | 467.39 | Calculated Property |
| η | 0.0002574 | Pa×s | 497.15 | Calculated Property |
| η | 0.0002019 | Pa×s | 526.90 | Calculated Property |
| η | 0.0001626 | Pa×s | 556.65 | Calculated Property |
Similar Compounds
Find more compounds similar to Hexadecane, 8-ethyl.
Sources
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