- InChI
- InChI=1S/C10H16O2/c1-5-10(4)7-6-8(11)9(2,3)12-10/h5H,1,6-7H2,2-4H3
- InChI Key
- ATQPZCOAQSYTPR-UHFFFAOYSA-N
- Formula
- C10H16O2
- SMILES
- C=CC1(C)CCC(=O)C(C)(C)O1
- Molecular Weight1
- 168.23
- CAS
- 33933-72-1
- Other Names
-
- 2H-Pyran-3(4H)-one, dihydro-2,2,6-trimethyl-6-vinyl-
- 2,2,6-Trimethyl-3-keto-6-vinyltetrahydropyran
- 6-Ethenyldihydro-2,2,6-trimethyl-2H-pyran-3(4H)-one
- 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° | -81.79 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -329.54 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 8.17 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 43.76 | kJ/mol | Joback Calculated Property |
| log10WS | -2.35 | Crippen Calculated Property | |
| logPoct/wat | 2.089 | Crippen Calculated Property | |
| McVol | 144.040 | ml/mol | McGowan Calculated Property |
| Pc | 2928.17 | kPa | Joback Calculated Property |
| Inp | [1106.00; 1109.00] |
|
|
| Inp | 1109.00 | NIST | |
| Inp | 1109.00 | NIST | |
| Inp | 1107.00 | NIST | |
| Inp | 1106.00 | NIST | |
| Inp | 1109.00 | NIST | |
| Inp | 1107.00 | NIST | |
| Tboil | 535.01 | K | Joback Calculated Property |
| Tc | 770.10 | K | Joback Calculated Property |
| Tfus | 346.43 | K | Joback Calculated Property |
| Vc | 0.532 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [351.47; 444.63] | J/mol×K | [535.01; 770.10] |
|
| Cp,gas | 351.47 | J/mol×K | 535.01 | Joback Calculated Property |
| Cp,gas | 369.18 | J/mol×K | 574.19 | Joback Calculated Property |
| Cp,gas | 385.73 | J/mol×K | 613.37 | Joback Calculated Property |
| Cp,gas | 401.35 | J/mol×K | 652.56 | Joback Calculated Property |
| Cp,gas | 416.23 | J/mol×K | 691.74 | Joback Calculated Property |
| Cp,gas | 430.58 | J/mol×K | 730.92 | Joback Calculated Property |
| Cp,gas | 444.63 | J/mol×K | 770.10 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2H-Pyran-3(4H)-one, 6-ethenyldihydro-2,2,6-trimethyl-.
Sources
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