- InChI
- InChI=1S/C32H66/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-32(4)30-31(2)3/h31-32H,5-30H2,1-4H3
- InChI Key
- VXERBJLXDSRCED-UHFFFAOYSA-N
- Formula
- C32H66
- SMILES
-
CCCCCCCCCCCCCCCCCCCCCCCCCCC(C)
CC(C)C - Molecular Weight1
- 450.87
- 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 | 1.2119 | Relay (1.0) Calculated Property | |
| ΔfG° | 213.68 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -727.89 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 71.59 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 152.39 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.20 | eV | Relay (1.0) Calculated Property |
| log10WS | -11.82 | Relay (1.0) Calculated Property | |
| logPoct/wat | 12.441 | Crippen Calculated Property | |
| McVol | 461.740 | ml/mol | McGowan Calculated Property |
| Pc | 547.43 | kPa | Joback Calculated Property |
| Inp | [3104.00; 3104.00] |
|
|
| Inp | 3104.00 | NIST | |
| Inp | 3104.00 | NIST | |
| Tboil | 652.23 | K | Relay (1.0) Calculated Property |
| Tc | 826.99 | K | Relay (1.0) Calculated Property |
| Tfus | 301.72 | K | Relay (1.0) Calculated Property |
| Vc | 1.809 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [683.69; 1671.32] | 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 | -2.95640e+01 | |||
| Coefficient B | 3.05568e+00 | |||
| Coefficient C | -1.72340e-03 | |||
| Coefficient D | 3.68600e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 683.69 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 852.09 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 1003.10 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 1137.89 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 1257.63 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 1363.48 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 1456.61 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 1538.18 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 1609.36 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 1671.32 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0012543; 0.0000260] | Pa×s | [420.40; 807.27] |
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 | -1.47668e+01 | |||
| Coefficient B | 3.39920e+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. | 420.40 | |||
| Temperature range, max. | 807.27 | |||
| η | 0.0012543 | Pa×s | 420.40 | Calculated Property |
| η | 0.0005925 | Pa×s | 463.39 | Calculated Property |
| η | 0.0003178 | Pa×s | 506.37 | Calculated Property |
| η | 0.0001880 | Pa×s | 549.36 | Calculated Property |
| η | 0.0001200 | Pa×s | 592.34 | Calculated Property |
| η | 0.0000814 | Pa×s | 635.33 | Calculated Property |
| η | 0.0000580 | Pa×s | 678.31 | Calculated Property |
| η | 0.0000430 | Pa×s | 721.30 | Calculated Property |
| η | 0.0000330 | Pa×s | 764.29 | Calculated Property |
| η | 0.0000260 | Pa×s | 807.27 | Calculated Property |
Similar Compounds
Find more compounds similar to 2,4-Dimethyltriacontane.
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