- InChI
- InChI=1S/C11H20O2/c1-3-5-6-7-8-9-10-13-11(12)4-2/h7-8H,3-6,9-10H2,1-2H3/b8-7+
- InChI Key
- NTQOADMSKSBQCI-BQYQJAHWSA-N
- Formula
- C11H20O2
- SMILES
- CCCCC=CCCOC(=O)CC
- Molecular Weight1
- 184.28
- CAS
- 94133-58-1
- Other Names
-
- oct-3-enyl propionate
- 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.
- I : 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 | 0.5500 | Relay (1.0) Calculated Property | |
| ΔfG° | -188.41 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -512.26 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 28.82 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 61.61 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.02 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.08 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.076 | Crippen Calculated Property | |
| McVol | 168.990 | ml/mol | McGowan Calculated Property |
| Pc | 2034.55 | kPa | Joback Calculated Property |
| Inp | 1180.00 | NIST | |
| I | [1432.00; 1432.00] |
|
|
| I | 1432.00 | NIST | |
| I | 1432.00 | NIST | |
| Tboil | 487.70 | K | Relay (1.0) Calculated Property |
| Tc | 668.64 | K | Relay (1.0) Calculated Property |
| Tfus | 205.39 | K | Relay (1.0) Calculated Property |
| Vc | 0.632 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [391.14; 471.12] | J/mol×K | [513.66; 689.00] |
|
| Cp,gas | 391.14 | J/mol×K | 513.66 | Joback Calculated Property |
| Cp,gas | 406.06 | J/mol×K | 542.88 | Joback Calculated Property |
| Cp,gas | 420.32 | J/mol×K | 572.11 | Joback Calculated Property |
| Cp,gas | 433.94 | J/mol×K | 601.33 | Joback Calculated Property |
| Cp,gas | 446.93 | J/mol×K | 630.55 | Joback Calculated Property |
| Cp,gas | 459.32 | J/mol×K | 659.78 | Joback Calculated Property |
| Cp,gas | 471.12 | J/mol×K | 689.00 | Joback Calculated Property |
| η | [0.0001610; 0.0052704] | Pa×s | [250.98; 513.66] |
|
| η | 0.0052704 | Pa×s | 250.98 | Joback Calculated Property |
| η | 0.0019134 | Pa×s | 294.76 | Joback Calculated Property |
| η | 0.0009027 | Pa×s | 338.54 | Joback Calculated Property |
| η | 0.0005059 | Pa×s | 382.32 | Joback Calculated Property |
| η | 0.0003193 | Pa×s | 426.10 | Joback Calculated Property |
| η | 0.0002196 | Pa×s | 469.88 | Joback Calculated Property |
| η | 0.0001610 | Pa×s | 513.66 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3-Octenyl propionate.
Sources
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