- InChI
- InChI=1S/C29H56O5/c1-5-6-7-8-9-10-11-12-13-14-15-16-20-24-33-28(30)21-18-17-19-22-29(31)34-27(3)26(2)23-25-32-4/h26-27H,5-25H2,1-4H3
- InChI Key
- BKTINWQNMXBDEN-UHFFFAOYSA-N
- Formula
- C29H56O5
- SMILES
-
CCCCCCCCCCCCCCCOC(=O)CCCCCC(=O
)OC(C)C(C)CCOC - Molecular Weight1
- 484.75
- 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° | -384.42 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1274.27 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 70.58 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 100.09 | kJ/mol | Joback Calculated Property |
| log10WS | -8.64 | Crippen Calculated Property | |
| logPoct/wat | 8.176 | Crippen Calculated Property | |
| McVol | 440.220 | ml/mol | McGowan Calculated Property |
| Pc | 653.77 | kPa | Joback Calculated Property |
| Inp | [3246.00; 3246.00] |
|
|
| Inp | 3246.00 | NIST | |
| Inp | 3246.00 | NIST | |
| Tboil | 1037.04 | K | Joback Calculated Property |
| Tc | 1296.45 | K | Joback Calculated Property |
| Tfus | 553.14 | K | Joback Calculated Property |
| Vc | 1.714 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1571.18; 1666.00] | J/mol×K | [1037.04; 1296.45] |
|
| Cp,gas | 1571.18 | J/mol×K | 1037.04 | Joback Calculated Property |
| Cp,gas | 1593.30 | J/mol×K | 1080.28 | Joback Calculated Property |
| Cp,gas | 1612.80 | J/mol×K | 1123.51 | Joback Calculated Property |
| Cp,gas | 1629.75 | J/mol×K | 1166.75 | Joback Calculated Property |
| Cp,gas | 1644.21 | J/mol×K | 1209.98 | Joback Calculated Property |
| Cp,gas | 1656.27 | J/mol×K | 1253.22 | Joback Calculated Property |
| Cp,gas | 1666.00 | J/mol×K | 1296.45 | Joback Calculated Property |
| η | [0.0000081; 0.0002316] | Pa×s | [553.14; 1037.04] |
|
| η | 0.0002316 | Pa×s | 553.14 | Joback Calculated Property |
| η | 0.0000928 | Pa×s | 633.79 | Joback Calculated Property |
| η | 0.0000457 | Pa×s | 714.44 | Joback Calculated Property |
| η | 0.0000260 | Pa×s | 795.09 | Joback Calculated Property |
| η | 0.0000164 | Pa×s | 875.74 | Joback Calculated Property |
| η | 0.0000112 | Pa×s | 956.39 | Joback Calculated Property |
| η | 0.0000081 | Pa×s | 1037.04 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Pimelic acid, 5-methoxy-3-methylpent-2-yl pentadecyl ester.
Sources
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