- InChI
- InChI=1S/C15H30O3/c1-4-6-7-8-9-10-11-15(16)18-14(3)13-17-12-5-2/h14H,4-13H2,1-3H3
- InChI Key
- KJHVXJNBYBNEGI-UHFFFAOYSA-N
- Formula
- C15H30O3
- SMILES
- CCCCCCCCC(=O)OC(C)COCCC
- Molecular Weight1
- 258.40
- 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 | 0.7907 | Relay (... Calculated Property | |
| ΔfG° | -265.94 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -815.19 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 35.06 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 77.68 | kJ/mol | Relay (... Calculated Property |
| IE | 9.53 | eV | Relay (... Calculated Property |
| log10WS | -4.06 | Relay (... Calculated Property | |
| logPoct/wat | 4.095 | Crippen Calculated Property | |
| McVol | 235.520 | ml/mol | McGowan Calculated Property |
| Pc | 1455.68 | kPa | Joback Calculated Property |
| Inp | [1675.00; 1675.00] |
|
|
| Inp | 1675.00 | NIST | |
| Inp | 1675.00 | NIST | |
| Tboil | 542.44 | K | Relay (... Calculated Property |
| Tc | 721.30 | K | Relay (... Calculated Property |
| Tfus | 230.92 | K | Relay (... Calculated Property |
| Vc | 0.901 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [651.33; 745.18] | J/mol×K | [640.87; 811.05] |
|
| Cp,gas | 651.33 | J/mol×K | 640.87 | Joback Calculated Property |
| Cp,gas | 668.79 | J/mol×K | 669.23 | Joback Calculated Property |
| Cp,gas | 685.51 | J/mol×K | 697.60 | Joback Calculated Property |
| Cp,gas | 701.51 | J/mol×K | 725.96 | Joback Calculated Property |
| Cp,gas | 716.78 | J/mol×K | 754.32 | Joback Calculated Property |
| Cp,gas | 731.33 | J/mol×K | 782.69 | Joback Calculated Property |
| Cp,gas | 745.18 | J/mol×K | 811.05 | Joback Calculated Property |
| η | [0.0000993; 0.0023029] | Pa×s | [338.20; 640.87] |
|
| η | 0.0023029 | Pa×s | 338.20 | Joback Calculated Property |
| η | 0.0009707 | Pa×s | 388.64 | Joback Calculated Property |
| η | 0.0004990 | Pa×s | 439.09 | Joback Calculated Property |
| η | 0.0002942 | Pa×s | 489.53 | Joback Calculated Property |
| η | 0.0001915 | Pa×s | 539.98 | Joback Calculated Property |
| η | 0.0001341 | Pa×s | 590.42 | Joback Calculated Property |
| η | 0.0000993 | Pa×s | 640.87 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1-Propoxypropan-2-yl nonanoate.
Sources
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