- InChI
- InChI=1S/C33H68/c1-5-7-9-11-21-25-29-33(4)31-27-23-20-18-16-14-12-13-15-17-19-22-26-30-32(3)28-24-10-8-6-2/h32-33H,5-31H2,1-4H3
- InChI Key
- HUVXJQXWNWYIEV-UHFFFAOYSA-N
- Formula
- C33H68
- SMILES
-
CCCCCCCCC(C)CCCCCCCCCCCCCCCC(C
)CCCCCC - Molecular Weight1
- 464.89
- 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 | 1.2285 | Relay (1.0) Calculated Property | |
| ΔfG° | 222.10 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -760.83 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 74.18 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 157.25 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.12 | eV | Relay (1.0) Calculated Property |
| log10WS | -12.03 | Relay (1.0) Calculated Property | |
| logPoct/wat | 12.831 | Crippen Calculated Property | |
| McVol | 475.830 | ml/mol | McGowan Calculated Property |
| Pc | 523.65 | kPa | Joback Calculated Property |
| Inp | 3170.00 | NIST | |
| Tboil | 659.18 | K | Relay (1.0) Calculated Property |
| Tc | 833.07 | K | Relay (1.0) Calculated Property |
| Tfus | 289.56 | K | Relay (1.0) Calculated Property |
| Vc | 1.859 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [704.91; 1722.91] | 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 | -3.04730e+01 | |||
| Coefficient B | 3.15068e+00 | |||
| Coefficient C | -1.77780e-03 | |||
| Coefficient D | 3.80500e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 704.91 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 878.51 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 1034.18 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 1173.12 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 1296.54 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 1405.64 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 1501.63 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 1585.70 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 1659.06 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 1722.91 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0010674; 0.0000218] | Pa×s | [431.67; 831.30] |
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 | -1.49352e+01 | |||
| Coefficient B | 3.49336e+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. | 431.67 | |||
| Temperature range, max. | 831.30 | |||
| η | 0.0010674 | Pa×s | 431.67 | Calculated Property |
| η | 0.0005018 | Pa×s | 476.07 | Calculated Property |
| η | 0.0002683 | Pa×s | 520.48 | Calculated Property |
| η | 0.0001583 | Pa×s | 564.88 | Calculated Property |
| η | 0.0001009 | Pa×s | 609.28 | Calculated Property |
| η | 0.0000683 | Pa×s | 653.69 | Calculated Property |
| η | 0.0000486 | Pa×s | 698.09 | Calculated Property |
| η | 0.0000361 | Pa×s | 742.49 | Calculated Property |
| η | 0.0000277 | Pa×s | 786.90 | Calculated Property |
| η | 0.0000218 | Pa×s | 831.30 | Calculated Property |
Similar Compounds
Find more compounds similar to 7,23-dimethylhentriacontane.
Sources
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