- InChI
- InChI=1S/C20H38O6/c1-17(23-3)13-15-25-19(21)11-9-7-5-6-8-10-12-20(22)26-16-14-18(2)24-4/h17-18H,5-16H2,1-4H3
- InChI Key
- VBNBOVAVLMAHMM-UHFFFAOYSA-N
- Formula
- C20H38O6
- SMILES
-
COC(C)CCOC(=O)CCCCCCCCC(=O)OCC
C(C)OC - Molecular Weight1
- 374.51
- 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 | 1.0379 | Relay (1.0) Calculated Property | |
| ΔfG° | -565.20 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1328.46 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 48.46 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 98.15 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.98 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.95 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.044 | Crippen Calculated Property | |
| McVol | 319.280 | ml/mol | McGowan Calculated Property |
| Pc | 1065.18 | kPa | Joback Calculated Property |
| Inp | [2447.00; 2447.00] |
|
|
| Inp | 2447.00 | NIST | |
| Inp | 2447.00 | NIST | |
| Tboil | 624.96 | K | Relay (1.0) Calculated Property |
| Tc | 791.03 | K | Relay (1.0) Calculated Property |
| Tfus | 270.38 | K | Relay (1.0) Calculated Property |
| Vc | 1.219 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1033.21; 1120.96] | J/mol×K | [853.54; 1045.67] |
|
| Cp,gas | 1033.21 | J/mol×K | 853.54 | Joback Calculated Property |
| Cp,gas | 1051.02 | J/mol×K | 885.56 | Joback Calculated Property |
| Cp,gas | 1067.56 | J/mol×K | 917.58 | Joback Calculated Property |
| Cp,gas | 1082.82 | J/mol×K | 949.60 | Joback Calculated Property |
| Cp,gas | 1096.81 | J/mol×K | 981.62 | Joback Calculated Property |
| Cp,gas | 1109.52 | J/mol×K | 1013.65 | Joback Calculated Property |
| Cp,gas | 1120.96 | J/mol×K | 1045.67 | Joback Calculated Property |
| η | [0.0000248; 0.0005246] | Pa×s | [473.94; 853.54] |
|
| η | 0.0005246 | Pa×s | 473.94 | Joback Calculated Property |
| η | 0.0002339 | Pa×s | 537.21 | Joback Calculated Property |
| η | 0.0001237 | Pa×s | 600.47 | Joback Calculated Property |
| η | 0.0000738 | Pa×s | 663.74 | Joback Calculated Property |
| η | 0.0000482 | Pa×s | 727.01 | Joback Calculated Property |
| η | 0.0000337 | Pa×s | 790.27 | Joback Calculated Property |
| η | 0.0000248 | Pa×s | 853.54 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to di-(3-Methoxybutyl)sebacate.
Sources
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