- InChI
- InChI=1S/C25H52/c1-7-13-20-24(9-3,10-4)22-18-16-15-17-19-23-25(11-5,12-6)21-14-8-2/h7-23H2,1-6H3
- InChI Key
- ZJANNPIATDOOLP-UHFFFAOYSA-N
- Formula
- C25H52
- SMILES
-
CCCCC(CC)(CC)CCCCCCCC(CC)(CC)C
CCC - Molecular Weight1
- 352.69
- 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 | 0.8397 | Relay (1.0) Calculated Property | |
| ΔfG° | 165.30 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -559.64 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 45.68 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 109.70 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.13 | eV | Relay (1.0) Calculated Property |
| log10WS | -8.98 | Relay (1.0) Calculated Property | |
| logPoct/wat | 9.710 | Crippen Calculated Property | |
| McVol | 363.110 | ml/mol | McGowan Calculated Property |
| Pc | 780.25 | kPa | Joback Calculated Property |
| Inp | [2330.00; 2330.00] |
|
|
| Inp | 2330.00 | NIST | |
| Inp | 2330.00 | NIST | |
| Tboil | 611.19 | K | Relay (1.0) Calculated Property |
| Tc | 792.38 | K | Relay (1.0) Calculated Property |
| Tfus | 242.19 | K | Relay (1.0) Calculated Property |
| Vc | 1.352 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [532.91; 1312.04] | 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 | -6.87830e+01 | |||
| Coefficient B | 2.63052e+00 | |||
| Coefficient C | -1.67980e-03 | |||
| Coefficient D | 4.30100e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 532.91 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 670.64 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 792.41 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 899.57 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 993.49 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 1075.53 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 1147.04 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 1209.39 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 1263.93 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 1312.04 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0023310; 0.0000647] | Pa×s | [376.35; 658.94] |
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 | -1.44194e+01 | |||
| Coefficient B | 3.14552e+03 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Comment | Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc. | |||
| Temperature range, min. | 376.35 | |||
| Temperature range, max. | 658.94 | |||
| η | 0.0023310 | Pa×s | 376.35 | Calculated Property |
| η | 0.0012247 | Pa×s | 407.75 | Calculated Property |
| η | 0.0007055 | Pa×s | 439.15 | Calculated Property |
| η | 0.0004374 | Pa×s | 470.55 | Calculated Property |
| η | 0.0002879 | Pa×s | 501.95 | Calculated Property |
| η | 0.0001991 | Pa×s | 533.35 | Calculated Property |
| η | 0.0001434 | Pa×s | 564.75 | Calculated Property |
| η | 0.0001070 | Pa×s | 596.15 | Calculated Property |
| η | 0.0000821 | Pa×s | 627.55 | Calculated Property |
| η | 0.0000647 | Pa×s | 658.94 | Calculated Property |
Similar Compounds
Find more compounds similar to 5,5,13,13-Tetraethylheptadecane.
Sources
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