- InChI
- InChI=1S/C22H42O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22(23)24-21-4-2/h4H,2-3,5-21H2,1H3
- InChI Key
- LHDOSLHSKWMXST-UHFFFAOYSA-N
- Formula
- C22H42O2
- SMILES
- C=CCOC(=O)CCCCCCCCCCCCCCCCCC
- Molecular Weight1
- 338.58
- 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 | 1.0017 | Relay (1.0) Calculated Property | |
| ΔfG° | -88.17 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -706.11 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 55.82 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 108.12 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.79 | eV | Relay (1.0) Calculated Property |
| log10WS | -7.40 | Relay (1.0) Calculated Property | |
| logPoct/wat | 7.367 | Crippen Calculated Property | |
| McVol | 323.980 | ml/mol | McGowan Calculated Property |
| Pc | 927.81 | kPa | Joback Calculated Property |
| Inp | [2351.00; 2351.00] |
|
|
| Inp | 2351.00 | NIST | |
| Inp | 2351.00 | NIST | |
| Tboil | 627.73 | K | Relay (1.0) Calculated Property |
| Tc | 799.28 | K | Relay (1.0) Calculated Property |
| Tfus | 292.00 | K | Relay (1.0) Calculated Property |
| Vc | 1.241 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [994.71; 1100.84] | J/mol×K | [757.86; 931.40] |
|
| Cp,gas | 994.71 | J/mol×K | 757.86 | Joback Calculated Property |
| Cp,gas | 1014.82 | J/mol×K | 786.78 | Joback Calculated Property |
| Cp,gas | 1033.92 | J/mol×K | 815.71 | Joback Calculated Property |
| Cp,gas | 1052.04 | J/mol×K | 844.63 | Joback Calculated Property |
| Cp,gas | 1069.22 | J/mol×K | 873.55 | Joback Calculated Property |
| Cp,gas | 1085.47 | J/mol×K | 902.47 | Joback Calculated Property |
| Cp,gas | 1100.84 | J/mol×K | 931.40 | Joback Calculated Property |
| η | [0.0000525; 0.0018917] | Pa×s | [378.27; 757.86] |
|
| η | 0.0018917 | Pa×s | 378.27 | Joback Calculated Property |
| η | 0.0006786 | Pa×s | 441.53 | Joback Calculated Property |
| η | 0.0003148 | Pa×s | 504.80 | Joback Calculated Property |
| η | 0.0001732 | Pa×s | 568.06 | Joback Calculated Property |
| η | 0.0001075 | Pa×s | 631.33 | Joback Calculated Property |
| η | 0.0000727 | Pa×s | 694.59 | Joback Calculated Property |
| η | 0.0000525 | Pa×s | 757.86 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Allyl nonadecanoate.
Sources
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