- InChI
- InChI=1S/C12H20O2/c1-6-10(4)7-8-12(9(2)3)14-11(5)13/h6,10,12H,1-2,7-8H2,3-5H3
- InChI Key
- ATOCHKMVAHBPNF-UHFFFAOYSA-N
- Formula
- C12H20O2
- SMILES
- C=CC(C)CCC(OC(C)=O)C(=C)C
- Molecular Weight1
- 196.29
- CAS
- 61382-99-8
- Other Names
-
- 1-isopropenyl-4-methylhex-5-enyl acetate
- 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).
- 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° | -21.51 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -305.30 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 18.71 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 49.43 | kJ/mol | Joback Calculated Property |
| log10WS | -3.29 | Crippen Calculated Property | |
| logPoct/wat | 3.096 | Crippen Calculated Property | |
| McVol | 178.780 | ml/mol | McGowan Calculated Property |
| Pc | 2030.89 | kPa | Joback Calculated Property |
| Tboil | 542.61 | K | Joback Calculated Property |
| Tc | 728.14 | K | Joback Calculated Property |
| Tfus | 249.68 | K | Joback Calculated Property |
| Vc | 0.682 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [425.09; 507.97] | J/mol×K | [542.61; 728.14] | 
|
| Cp,gas | 425.09 | J/mol×K | 542.61 | Joback Calculated Property |
| Cp,gas | 440.64 | J/mol×K | 573.53 | Joback Calculated Property |
| Cp,gas | 455.47 | J/mol×K | 604.45 | Joback Calculated Property |
| Cp,gas | 469.60 | J/mol×K | 635.38 | Joback Calculated Property |
| Cp,gas | 483.04 | J/mol×K | 666.30 | Joback Calculated Property |
| Cp,gas | 495.83 | J/mol×K | 697.22 | Joback Calculated Property |
| Cp,gas | 507.97 | J/mol×K | 728.14 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2,6-Dimethyl-1,7-octadien-3-ol, acetate.
Sources
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