- InChI
- InChI=1S/C12H20O2/c1-9-5-6-11(12(9,3)4)7-8-14-10(2)13/h5,11H,6-8H2,1-4H3
- InChI Key
- HBRWKAJTMKFEQR-UHFFFAOYSA-N
- Formula
- C12H20O2
- SMILES
- CC(=O)OCCC1CC=C(C)C1(C)C
- Molecular Weight1
- 196.29
- 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.
- I : 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° | -140.08 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -434.12 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 19.16 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 51.21 | kJ/mol | Joback Calculated Property |
| log10WS | -2.97 | Crippen Calculated Property | |
| logPoct/wat | 2.932 | Crippen Calculated Property | |
| McVol | 172.220 | ml/mol | McGowan Calculated Property |
| Pc | 2244.00 | kPa | Joback Calculated Property |
| Inp | [1313.00; 1317.00] |
|
|
| Inp | 1316.00 | NIST | |
| Inp | 1313.00 | NIST | |
| Inp | 1317.00 | NIST | |
| Inp | 1316.00 | NIST | |
| I | [1681.00; 1681.00] |
|
|
| I | 1681.00 | NIST | |
| I | 1681.00 | NIST | |
| Tboil | 565.24 | K | Joback Calculated Property |
| Tc | 768.19 | K | Joback Calculated Property |
| Tfus | 341.00 | K | Joback Calculated Property |
| Vc | 0.655 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [433.72; 524.55] | J/mol×K | [565.24; 768.19] |
|
| Cp,gas | 433.72 | J/mol×K | 565.24 | Joback Calculated Property |
| Cp,gas | 450.77 | J/mol×K | 599.06 | Joback Calculated Property |
| Cp,gas | 466.95 | J/mol×K | 632.89 | Joback Calculated Property |
| Cp,gas | 482.34 | J/mol×K | 666.71 | Joback Calculated Property |
| Cp,gas | 497.01 | J/mol×K | 700.54 | Joback Calculated Property |
| Cp,gas | 511.05 | J/mol×K | 734.36 | Joback Calculated Property |
| Cp,gas | 524.55 | J/mol×K | 768.19 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to «alpha»-Campholenyl acetate.
Sources
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