- InChI
- InChI=1S/C33H64O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-33(35)31-32(2)34/h3-31H2,1-2H3
- InChI Key
- HDWXUNKGEVGZSN-UHFFFAOYSA-N
- Formula
- C33H64O2
- SMILES
-
CCCCCCCCCCCCCCCCCCCCCCCCCCCCCC
(=O)CC(C)=O - Molecular Weight1
- 492.86
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | -30.86 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -949.61 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 84.42 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 102.54 | kJ/mol | Joback Calculated Property |
| log10WS | -12.20 | Crippen Calculated Property | |
| logPoct/wat | 11.477 | Crippen Calculated Property | |
| McVol | 478.970 | ml/mol | McGowan Calculated Property |
| Pc | 551.04 | kPa | Joback Calculated Property |
| Inp | [3638.10; 3638.10] |
|
|
| Inp | 3638.10 | NIST | |
| Inp | 3638.10 | NIST | |
| Tboil | 1062.18 | K | Joback Calculated Property |
| Tc | 1347.99 | K | Joback Calculated Property |
| Tfus | 561.53 | K | Joback Calculated Property |
| Vc | 1.895 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1741.31; 1882.60] | J/mol×K | [1062.18; 1347.99] |
|
| Cp,gas | 1741.31 | J/mol×K | 1062.18 | Joback Calculated Property |
| Cp,gas | 1770.02 | J/mol×K | 1109.81 | Joback Calculated Property |
| Cp,gas | 1796.35 | J/mol×K | 1157.45 | Joback Calculated Property |
| Cp,gas | 1820.53 | J/mol×K | 1205.08 | Joback Calculated Property |
| Cp,gas | 1842.81 | J/mol×K | 1252.72 | Joback Calculated Property |
| Cp,gas | 1863.42 | J/mol×K | 1300.35 | Joback Calculated Property |
| Cp,gas | 1882.60 | J/mol×K | 1347.99 | Joback Calculated Property |
| η | [0.0000133; 0.0003536] | Pa×s | [561.53; 1062.18] |
|
| η | 0.0003536 | Pa×s | 561.53 | Joback Calculated Property |
| η | 0.0001436 | Pa×s | 644.97 | Joback Calculated Property |
| η | 0.0000717 | Pa×s | 728.41 | Joback Calculated Property |
| η | 0.0000413 | Pa×s | 811.85 | Joback Calculated Property |
| η | 0.0000264 | Pa×s | 895.30 | Joback Calculated Property |
| η | 0.0000182 | Pa×s | 978.74 | Joback Calculated Property |
| η | 0.0000133 | Pa×s | 1062.18 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Tritriacontan-2,4-dione.
Sources
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