- InChI
- InChI=1S/C27H56O/c1-4-24-27(2)25-22-20-18-16-14-12-10-8-6-5-7-9-11-13-15-17-19-21-23-26-28-3/h27H,4-26H2,1-3H3
- InChI Key
- PNVHLUPDDVUJQL-UHFFFAOYSA-N
- Formula
- C27H56O
- SMILES
- CCCC(C)CCCCCCCCCCCCCCCCCCCCCOC
- Molecular Weight1
- 396.73
- 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 | 1.1011 | Relay (... Calculated Property | |
| ΔfG° | 69.02 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -732.00 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 63.35 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 133.08 | kJ/mol | Relay (... Calculated Property |
| IE | 9.87 | eV | Relay (... Calculated Property |
| log10WS | -9.51 | Relay (... Calculated Property | |
| logPoct/wat | 9.871 | Crippen Calculated Property | |
| McVol | 397.160 | ml/mol | McGowan Calculated Property |
| Pc | 685.65 | kPa | Joback Calculated Property |
| Inp | [2790.00; 2790.00] |
|
|
| Inp | 2790.00 | NIST | |
| Inp | 2790.00 | NIST | |
| Tboil | 631.70 | K | Relay (... Calculated Property |
| Tc | 806.02 | K | Relay (... Calculated Property |
| Tfus | 303.13 | K | Relay (... Calculated Property |
| Vc | 1.536 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1318.67; 1447.90] | J/mol×K | [839.14; 1028.31] |
|
| Cp,gas | 1318.67 | J/mol×K | 839.14 | Joback Calculated Property |
| Cp,gas | 1343.39 | J/mol×K | 870.67 | Joback Calculated Property |
| Cp,gas | 1366.77 | J/mol×K | 902.20 | Joback Calculated Property |
| Cp,gas | 1388.86 | J/mol×K | 933.72 | Joback Calculated Property |
| Cp,gas | 1409.72 | J/mol×K | 965.25 | Joback Calculated Property |
| Cp,gas | 1429.38 | J/mol×K | 996.78 | Joback Calculated Property |
| Cp,gas | 1447.90 | J/mol×K | 1028.31 | Joback Calculated Property |
| η | [0.0000259; 0.0013017] | Pa×s | [401.28; 839.14] |
|
| η | 0.0013017 | Pa×s | 401.28 | Joback Calculated Property |
| η | 0.0004100 | Pa×s | 474.26 | Joback Calculated Property |
| η | 0.0001758 | Pa×s | 547.23 | Joback Calculated Property |
| η | 0.0000920 | Pa×s | 620.21 | Joback Calculated Property |
| η | 0.0000551 | Pa×s | 693.19 | Joback Calculated Property |
| η | 0.0000365 | Pa×s | 766.16 | Joback Calculated Property |
| η | 0.0000259 | Pa×s | 839.14 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1-Methoxy-22-methylpentacosane.
Sources
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