- InChI
- InChI=1S/C26H54O/c1-5-6-7-8-12-15-18-21-25(2)22-19-16-13-10-9-11-14-17-20-23-26(3)24-27-4/h25-26H,5-24H2,1-4H3
- InChI Key
- LXVPVPHXQIMEKA-UHFFFAOYSA-N
- Formula
- C26H54O
- SMILES
-
CCCCCCCCCC(C)CCCCCCCCCCCC(C)CO
C - Molecular Weight1
- 382.72
- 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 | 1.0308 | Relay (1.0) Calculated Property | |
| ΔfG° | 58.16 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -723.72 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 57.24 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 124.00 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.62 | eV | Relay (1.0) Calculated Property |
| log10WS | -9.29 | Relay (1.0) Calculated Property | |
| logPoct/wat | 9.337 | Crippen Calculated Property | |
| McVol | 383.070 | ml/mol | McGowan Calculated Property |
| Pc | 724.57 | kPa | Joback Calculated Property |
| Inp | [2606.00; 2606.00] |
|
|
| Inp | 2606.00 | NIST | |
| Inp | 2606.00 | NIST | |
| Tboil | 625.95 | K | Relay (1.0) Calculated Property |
| Tc | 804.24 | K | Relay (1.0) Calculated Property |
| Tfus | 276.32 | K | Relay (1.0) Calculated Property |
| Vc | 1.468 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [571.81; 1380.27] | 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 | 1.39000e+00 | |||
| Coefficient B | 2.42248e+00 | |||
| Coefficient C | -1.28600e-03 | |||
| Coefficient D | 2.42400e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 571.81 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 708.19 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 831.14 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 941.43 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 1039.83 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 1127.10 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 1204.01 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 1271.34 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 1329.83 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 1380.27 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0019511; 0.0000504] | Pa×s | [375.01; 699.33] |
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 | -1.41227e+01 | |||
| Coefficient B | 2.95633e+03 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 375.01 | |||
| Temperature range, max. | 699.33 | |||
| η | 0.0019511 | Pa×s | 375.01 | Calculated Property |
| η | 0.0009775 | Pa×s | 411.05 | Calculated Property |
| η | 0.0005475 | Pa×s | 447.08 | Calculated Property |
| η | 0.0003343 | Pa×s | 483.12 | Calculated Property |
| η | 0.0002186 | Pa×s | 519.15 | Calculated Property |
| η | 0.0001511 | Pa×s | 555.19 | Calculated Property |
| η | 0.0001092 | Pa×s | 591.22 | Calculated Property |
| η | 0.0000819 | Pa×s | 627.26 | Calculated Property |
| η | 0.0000634 | Pa×s | 663.29 | Calculated Property |
| η | 0.0000504 | Pa×s | 699.33 | Calculated Property |
Similar Compounds
Find more compounds similar to 1-Methoxy-2,14-dimethyltricosane.
Sources
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