- InChI
- InChI=1S/C33H66O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-21-24-27-30-33(2)31-28-25-22-19-17-20-23-26-29-32-34/h32-33H,3-31H2,1-2H3
- InChI Key
- FUWIDCPSLWQYJR-UHFFFAOYSA-N
- Formula
- C33H66O
- SMILES
-
CCCCCCCCCCCCCCCCCCCCC(C)CCCCCC
CCCCC=O - Molecular Weight1
- 478.88
- 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 | 1.3364 | Relay (1.0) Calculated Property | |
| ΔfG° | 125.02 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -841.35 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 79.99 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 162.97 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.19 | eV | Relay (1.0) Calculated Property |
| log10WS | -11.01 | Relay (1.0) Calculated Property | |
| logPoct/wat | 12.154 | Crippen Calculated Property | |
| McVol | 477.400 | ml/mol | McGowan Calculated Property |
| Pc | 539.83 | kPa | Joback Calculated Property |
| Inp | 3462.00 | NIST | |
| Tboil | 682.76 | K | Relay (1.0) Calculated Property |
| Tc | 870.34 | K | Relay (1.0) Calculated Property |
| Tfus | 332.11 | K | Relay (1.0) Calculated Property |
| Vc | 1.836 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1715.06; 1865.21] | J/mol×K | [1002.66; 1261.41] | 
|
| Cp,gas | 1715.06 | J/mol×K | 1002.66 | Joback Calculated Property |
| Cp,gas | 1744.86 | J/mol×K | 1045.78 | Joback Calculated Property |
| Cp,gas | 1772.51 | J/mol×K | 1088.91 | Joback Calculated Property |
| Cp,gas | 1798.19 | J/mol×K | 1132.03 | Joback Calculated Property |
| Cp,gas | 1822.07 | J/mol×K | 1175.16 | Joback Calculated Property |
| Cp,gas | 1844.36 | J/mol×K | 1218.28 | Joback Calculated Property |
| Cp,gas | 1865.21 | J/mol×K | 1261.41 | Joback Calculated Property |
| η | [0.0000147; 0.0006755] | Pa×s | [488.67; 1002.66] |
|
| η | 0.0006755 | Pa×s | 488.67 | Joback Calculated Property |
| η | 0.0002218 | Pa×s | 574.33 | Joback Calculated Property |
| η | 0.0000973 | Pa×s | 660.00 | Joback Calculated Property |
| η | 0.0000515 | Pa×s | 745.66 | Joback Calculated Property |
| η | 0.0000311 | Pa×s | 831.33 | Joback Calculated Property |
| η | 0.0000207 | Pa×s | 917.00 | Joback Calculated Property |
| η | 0.0000147 | Pa×s | 1002.66 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Dotriacontanal, 12-methyl.
Sources
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