- InChI
- InChI=1S/C26H50O5/c1-4-6-8-10-11-16-23-30-25(27)20-14-12-15-21-26(28)31-24(19-17-22-29-3)18-13-9-7-5-2/h24H,4-23H2,1-3H3
- InChI Key
- ZUPGLURYMAHPTL-UHFFFAOYSA-N
- Formula
- C26H50O5
- SMILES
-
CCCCCCCCOC(=O)CCCCCC(=O)OC(CCC
CCC)CCCOC - Molecular Weight1
- 442.67
- 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 | 1.2351 | Relay (1.0) Calculated Property | |
| ΔfG° | -407.24 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1312.80 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 66.33 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 116.56 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.34 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.82 | Relay (1.0) Calculated Property | |
| logPoct/wat | 7.149 | Crippen Calculated Property | |
| McVol | 397.950 | ml/mol | McGowan Calculated Property |
| Pc | 758.49 | kPa | Joback Calculated Property |
| Inp | [2890.00; 2890.00] |
|
|
| Inp | 2890.00 | NIST | |
| Inp | 2890.00 | NIST | |
| Tboil | 662.51 | K | Relay (1.0) Calculated Property |
| Tc | 831.85 | K | Relay (1.0) Calculated Property |
| Tfus | 273.19 | K | Relay (1.0) Calculated Property |
| Vc | 1.511 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1377.50; 1473.97] | J/mol×K | [968.84; 1195.64] |
|
| Cp,gas | 1377.50 | J/mol×K | 968.84 | Joback Calculated Property |
| Cp,gas | 1398.28 | J/mol×K | 1006.64 | Joback Calculated Property |
| Cp,gas | 1417.13 | J/mol×K | 1044.44 | Joback Calculated Property |
| Cp,gas | 1434.09 | J/mol×K | 1082.24 | Joback Calculated Property |
| Cp,gas | 1449.19 | J/mol×K | 1120.04 | Joback Calculated Property |
| Cp,gas | 1462.47 | J/mol×K | 1157.84 | Joback Calculated Property |
| Cp,gas | 1473.97 | J/mol×K | 1195.64 | Joback Calculated Property |
| η | [0.0000145; 0.0003107] | Pa×s | [534.33; 968.84] |
|
| η | 0.0003107 | Pa×s | 534.33 | Joback Calculated Property |
| η | 0.0001373 | Pa×s | 606.75 | Joback Calculated Property |
| η | 0.0000722 | Pa×s | 679.17 | Joback Calculated Property |
| η | 0.0000430 | Pa×s | 751.58 | Joback Calculated Property |
| η | 0.0000281 | Pa×s | 824.00 | Joback Calculated Property |
| η | 0.0000196 | Pa×s | 896.42 | Joback Calculated Property |
| η | 0.0000145 | Pa×s | 968.84 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Pimelic acid, 1-methoxydec-4-yl octyl ester.
Sources
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