- InChI
- InChI=1S/C35H68O4/c1-5-9-11-13-15-17-19-20-21-22-24-26-28-30-32-39-34(37)35(7-3,8-4)33(36)38-31-29-27-25-23-18-16-14-12-10-6-2/h5-32H2,1-4H3
- InChI Key
- NBGYVLRAJKCFLN-UHFFFAOYSA-N
- Formula
- C35H68O4
- SMILES
-
CCCCCCCCCCCCCCCCOC(=O)C(CC)(CC
)C(=O)OCCCCCCCCCCCC - Molecular Weight1
- 552.91
- 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 | 1.4605 | Relay (1.0) Calculated Property | |
| ΔfG° | -221.18 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1344.45 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 84.57 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 150.55 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.83 | eV | Relay (1.0) Calculated Property |
| log10WS | -9.81 | Relay (1.0) Calculated Property | |
| logPoct/wat | 11.281 | Crippen Calculated Property | |
| McVol | 518.890 | ml/mol | McGowan Calculated Property |
| Pc | 501.15 | kPa | Joback Calculated Property |
| Inp | 3547.00 | NIST | |
| Tboil | 694.67 | K | Relay (1.0) Calculated Property |
| Tc | 884.49 | K | Relay (1.0) Calculated Property |
| Tfus | 312.19 | K | Relay (1.0) Calculated Property |
| Vc | 1.974 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1936.06; 2065.87] | J/mol×K | [1149.55; 1495.51] | 
|
| Cp,gas | 1936.06 | J/mol×K | 1149.55 | Joback Calculated Property |
| Cp,gas | 1965.11 | J/mol×K | 1207.21 | Joback Calculated Property |
| Cp,gas | 1990.66 | J/mol×K | 1264.87 | Joback Calculated Property |
| Cp,gas | 2013.11 | J/mol×K | 1322.53 | Joback Calculated Property |
| Cp,gas | 2032.86 | J/mol×K | 1380.19 | Joback Calculated Property |
| Cp,gas | 2050.31 | J/mol×K | 1437.85 | Joback Calculated Property |
| Cp,gas | 2065.87 | J/mol×K | 1495.51 | Joback Calculated Property |
| η | [0.0000037; 0.0000975] | Pa×s | [630.95; 1149.55] |
|
| η | 0.0000975 | Pa×s | 630.95 | Joback Calculated Property |
| η | 0.0000406 | Pa×s | 717.38 | Joback Calculated Property |
| η | 0.0000204 | Pa×s | 803.82 | Joback Calculated Property |
| η | 0.0000118 | Pa×s | 890.25 | Joback Calculated Property |
| η | 0.0000075 | Pa×s | 976.68 | Joback Calculated Property |
| η | 0.0000051 | Pa×s | 1063.12 | Joback Calculated Property |
| η | 0.0000037 | Pa×s | 1149.55 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diethylmalonic acid, dodecyl hexadecyl ester.
Sources
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