- InChI
- InChI=1S/C16H30O3/c1-3-5-7-8-9-10-11-12-13-15-19-16(17)18-14-6-4-2/h4H,2-3,5-15H2,1H3
- InChI Key
- NICBOLAIDRXZLQ-UHFFFAOYSA-N
- Formula
- C16H30O3
- SMILES
- C=CCCOC(=O)OCCCCCCCCCCC
- Molecular Weight1
- 270.41
- 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 | 0.8415 | Relay (1.0) Calculated Property | |
| ΔfG° | -167.24 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -748.27 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 39.89 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 89.22 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.75 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.23 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.247 | Crippen Calculated Property | |
| McVol | 245.310 | ml/mol | McGowan Calculated Property |
| Pc | 1389.18 | kPa | Joback Calculated Property |
| Inp | [1823.00; 1823.00] |
|
|
| Inp | 1823.00 | NIST | |
| Inp | 1823.00 | NIST | |
| Tboil | 586.57 | K | Relay (1.0) Calculated Property |
| Tc | 724.34 | K | Relay (1.0) Calculated Property |
| Tfus | 241.40 | K | Relay (1.0) Calculated Property |
| Vc | 0.933 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [683.38; 775.46] | J/mol×K | [660.87; 830.71] |
|
| Cp,gas | 683.38 | J/mol×K | 660.87 | Joback Calculated Property |
| Cp,gas | 700.56 | J/mol×K | 689.18 | Joback Calculated Property |
| Cp,gas | 717.00 | J/mol×K | 717.48 | Joback Calculated Property |
| Cp,gas | 732.69 | J/mol×K | 745.79 | Joback Calculated Property |
| Cp,gas | 747.66 | J/mol×K | 774.10 | Joback Calculated Property |
| Cp,gas | 761.91 | J/mol×K | 802.40 | Joback Calculated Property |
| Cp,gas | 775.46 | J/mol×K | 830.71 | Joback Calculated Property |
| η | [0.0000991; 0.0016121] | Pa×s | [362.71; 660.87] |
|
| η | 0.0016121 | Pa×s | 362.71 | Joback Calculated Property |
| η | 0.0007654 | Pa×s | 412.40 | Joback Calculated Property |
| η | 0.0004265 | Pa×s | 462.10 | Joback Calculated Property |
| η | 0.0002663 | Pa×s | 511.79 | Joback Calculated Property |
| η | 0.0001807 | Pa×s | 561.48 | Joback Calculated Property |
| η | 0.0001306 | Pa×s | 611.18 | Joback Calculated Property |
| η | 0.0000991 | Pa×s | 660.87 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Carbonic acid, but-3-en-1-yl undecyl ester.
Sources
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