- InChI
- InChI=1S/C13H24O3/c1-5-15-13(14)16-10-9-12(4)8-6-7-11(2)3/h7,12H,5-6,8-10H2,1-4H3
- InChI Key
- GXKOFANEAPTOJI-UHFFFAOYSA-N
- Formula
- C13H24O3
- SMILES
- CCOC(=O)OCCC(C)CCC=C(C)C
- Molecular Weight1
- 228.33
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | -211.11 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -586.52 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 28.77 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 55.75 | kJ/mol | Joback Calculated Property |
| log10WS | -3.80 | Crippen Calculated Property | |
| logPoct/wat | 3.932 | Crippen Calculated Property | |
| McVol | 203.040 | ml/mol | McGowan Calculated Property |
| Pc | 1777.34 | kPa | Joback Calculated Property |
| Inp | 1514.00 | NIST | |
| Tboil | 599.15 | K | Joback Calculated Property |
| Tc | 779.29 | K | Joback Calculated Property |
| Tfus | 296.62 | K | Joback Calculated Property |
| Vc | 0.780 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [523.94; 610.84] | J/mol×K | [599.15; 779.29] | 
|
| Cp,gas | 523.94 | J/mol×K | 599.15 | Joback Calculated Property |
| Cp,gas | 540.16 | J/mol×K | 629.17 | Joback Calculated Property |
| Cp,gas | 555.66 | J/mol×K | 659.20 | Joback Calculated Property |
| Cp,gas | 570.47 | J/mol×K | 689.22 | Joback Calculated Property |
| Cp,gas | 584.60 | J/mol×K | 719.24 | Joback Calculated Property |
| Cp,gas | 598.05 | J/mol×K | 749.26 | Joback Calculated Property |
| Cp,gas | 610.84 | J/mol×K | 779.29 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3,7-Dimethyloct-6-enyl ethyl carbonate.
Sources
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