- InChI
- InChI=1S/C24H44O7/c1-4-7-10-13-16-29-21(25)19-24(28,23(27)31-18-15-12-9-6-3)20-22(26)30-17-14-11-8-5-2/h28H,4-20H2,1-3H3
- InChI Key
- AMMPRZCMKXDUNE-UHFFFAOYSA-N
- Formula
- C24H44O7
- SMILES
-
CCCCCCOC(=O)CC(O)(CC(=O)OCCCCC
C)C(=O)OCCCCCC - Molecular Weight1
- 444.60
- CAS
- 16544-70-0
- 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).
- 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° | -684.54 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1434.07 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 62.95 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 111.87 | kJ/mol | Joback Calculated Property |
| log10WS | -5.83 | Crippen Calculated Property | |
| logPoct/wat | 4.868 | Crippen Calculated Property | |
| McVol | 377.210 | ml/mol | McGowan Calculated Property |
| Pc | 933.49 | kPa | Joback Calculated Property |
| Tboil | 1066.34 | K | Joback Calculated Property |
| Tc | 1331.50 | K | Joback Calculated Property |
| Tfus | 639.96 | K | Joback Calculated Property |
| Vc | 1.460 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1329.05; 1397.27] | J/mol×K | [1066.34; 1331.50] | 
|
| Cp,gas | 1329.05 | J/mol×K | 1066.34 | Joback Calculated Property |
| Cp,gas | 1345.48 | J/mol×K | 1110.53 | Joback Calculated Property |
| Cp,gas | 1359.77 | J/mol×K | 1154.73 | Joback Calculated Property |
| Cp,gas | 1372.00 | J/mol×K | 1198.92 | Joback Calculated Property |
| Cp,gas | 1382.28 | J/mol×K | 1243.12 | Joback Calculated Property |
| Cp,gas | 1390.67 | J/mol×K | 1287.31 | Joback Calculated Property |
| Cp,gas | 1397.27 | J/mol×K | 1331.50 | Joback Calculated Property |
| η | [0.0000016; 0.0000556] | Pa×s | [639.96; 1066.34] |
|
| η | 0.0000556 | Pa×s | 639.96 | Joback Calculated Property |
| η | 0.0000231 | Pa×s | 711.02 | Joback Calculated Property |
| η | 0.0000112 | Pa×s | 782.09 | Joback Calculated Property |
| η | 0.0000062 | Pa×s | 853.15 | Joback Calculated Property |
| η | 0.0000037 | Pa×s | 924.21 | Joback Calculated Property |
| η | 0.0000024 | Pa×s | 995.28 | Joback Calculated Property |
| η | 0.0000016 | Pa×s | 1066.34 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,2,3-Propanetricarboxylic acid, 2-hydroxy-, trihexyl ester.
Sources
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