- InChI
- InChI=1S/C11H18O7/c1-16-8(12)4-6-11(15,10(14)18-3)7-5-9(13)17-2/h15H,4-7H2,1-3H3
- InChI Key
- XUAJBOMRONHLNB-UHFFFAOYSA-N
- Formula
- C11H18O7
- SMILES
-
COC(=O)CCC(O)(CCC(=O)OC)C(=O)O
C - Molecular Weight1
- 262.26
- 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° | -794.00 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1165.75 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 29.28 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 82.93 | kJ/mol | Joback Calculated Property |
| log10WS | -0.39 | Crippen Calculated Property | |
| logPoct/wat | -0.203 | Crippen Calculated Property | |
| McVol | 194.040 | ml/mol | McGowan Calculated Property |
| Pc | 2438.65 | kPa | Joback Calculated Property |
| Inp | 1473.00 | NIST | |
| Tboil | 768.90 | K | Joback Calculated Property |
| Tc | 958.07 | K | Joback Calculated Property |
| Tfus | 493.45 | K | Joback Calculated Property |
| Vc | 0.732 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [566.53; 620.96] | J/mol×K | [768.90; 958.07] | 
|
| Cp,gas | 566.53 | J/mol×K | 768.90 | Joback Calculated Property |
| Cp,gas | 577.41 | J/mol×K | 800.43 | Joback Calculated Property |
| Cp,gas | 587.56 | J/mol×K | 831.96 | Joback Calculated Property |
| Cp,gas | 596.98 | J/mol×K | 863.49 | Joback Calculated Property |
| Cp,gas | 605.69 | J/mol×K | 895.01 | Joback Calculated Property |
| Cp,gas | 613.68 | J/mol×K | 926.54 | Joback Calculated Property |
| Cp,gas | 620.96 | J/mol×K | 958.07 | Joback Calculated Property |
| η | [0.0000203; 0.0004983] | Pa×s | [493.45; 768.90] |
|
| η | 0.0004983 | Pa×s | 493.45 | Joback Calculated Property |
| η | 0.0002328 | Pa×s | 539.36 | Joback Calculated Property |
| η | 0.0001226 | Pa×s | 585.27 | Joback Calculated Property |
| η | 0.0000709 | Pa×s | 631.17 | Joback Calculated Property |
| η | 0.0000441 | Pa×s | 677.08 | Joback Calculated Property |
| η | 0.0000292 | Pa×s | 722.99 | Joback Calculated Property |
| η | 0.0000203 | Pa×s | 768.90 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,3,5-Pentanetricarboxylic acid, 3-hydroxy-2-methyl, trimethyl ester.
Sources
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