- InChI
- InChI=1S/C27H52O5/c1-5-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-31-25(28)27(6-2,7-3)26(29)32-24-23-30-4/h5-24H2,1-4H3
- InChI Key
- UXJNCVMBZHPGAZ-UHFFFAOYSA-N
- Formula
- C27H52O5
- SMILES
-
CCCCCCCCCCCCCCCCCOC(=O)C(CC)(C
C)C(=O)OCCOC - Molecular Weight1
- 456.70
- 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 | 1.2138 | Relay (1.0) Calculated Property | |
| ΔfG° | -393.54 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1299.27 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 65.03 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 124.54 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.59 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.76 | Relay (1.0) Calculated Property | |
| logPoct/wat | 7.397 | Crippen Calculated Property | |
| McVol | 412.040 | ml/mol | McGowan Calculated Property |
| Pc | 724.18 | kPa | Joback Calculated Property |
| Inp | 2927.00 | NIST | |
| Tboil | 659.58 | K | Relay (1.0) Calculated Property |
| Tc | 842.99 | K | Relay (1.0) Calculated Property |
| Tfus | 303.76 | K | Relay (1.0) Calculated Property |
| Vc | 1.541 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1441.07; 1540.58] | J/mol×K | [988.93; 1221.53] | 
|
| Cp,gas | 1441.07 | J/mol×K | 988.93 | Joback Calculated Property |
| Cp,gas | 1462.16 | J/mol×K | 1027.70 | Joback Calculated Property |
| Cp,gas | 1481.36 | J/mol×K | 1066.46 | Joback Calculated Property |
| Cp,gas | 1498.74 | J/mol×K | 1105.23 | Joback Calculated Property |
| Cp,gas | 1514.35 | J/mol×K | 1144.00 | Joback Calculated Property |
| Cp,gas | 1528.27 | J/mol×K | 1182.77 | Joback Calculated Property |
| Cp,gas | 1540.58 | J/mol×K | 1221.53 | Joback Calculated Property |
| η | [0.0000102; 0.0002106] | Pa×s | [563.02; 988.93] |
|
| η | 0.0002106 | Pa×s | 563.02 | Joback Calculated Property |
| η | 0.0000960 | Pa×s | 634.00 | Joback Calculated Property |
| η | 0.0000512 | Pa×s | 704.99 | Joback Calculated Property |
| η | 0.0000307 | Pa×s | 775.97 | Joback Calculated Property |
| η | 0.0000200 | Pa×s | 846.96 | Joback Calculated Property |
| η | 0.0000140 | Pa×s | 917.94 | Joback Calculated Property |
| η | 0.0000102 | Pa×s | 988.93 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diethylmalonic acid, heptadecyl 2-methoxyethyl ester.
Sources
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