- InChI
- InChI=1S/C12H20O2/c1-7-10-5-9(12(10,3)4)6-11(7)14-8(2)13/h7,9-11H,5-6H2,1-4H3/t7?,9-,10+,11-/m0/s1
- InChI Key
- KKZUXVTWZQWUSI-OHDVHENBSA-N
- Formula
- C12H20O2
- SMILES
- CC(=O)OC1CC2CC(C1C)C2(C)C
- Molecular Weight1
- 196.29
- ω : Acentric Factor.
- 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).
- 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 | 0.4141 | Relay (... Calculated Property | |
| ΔfG° | -102.98 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -475.90 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 20.71 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 67.02 | kJ/mol | Relay (... Calculated Property |
| IE | 8.95 | eV | Relay (... Calculated Property |
| log10WS | -3.26 | Relay (... Calculated Property | |
| logPoct/wat | 2.620 | Crippen Calculated Property | |
| McVol | 165.660 | ml/mol | McGowan Calculated Property |
| Pc | 2282.77 | kPa | Joback Calculated Property |
| Inp | [1290.00; 1290.00] |
|
|
| Inp | 1290.00 | NIST | |
| Inp | 1290.00 | NIST | |
| Tboil | 491.51 | K | Relay (... Calculated Property |
| Tc | 743.53 | K | Relay (... Calculated Property |
| Tfus | 316.33 | K | Relay (... Calculated Property |
| Vc | 0.568 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [439.79; 541.10] | J/mol×K | [554.23; 761.49] |
|
| Cp,gas | 439.79 | J/mol×K | 554.23 | Joback Calculated Property |
| Cp,gas | 459.08 | J/mol×K | 588.77 | Joback Calculated Property |
| Cp,gas | 477.26 | J/mol×K | 623.32 | Joback Calculated Property |
| Cp,gas | 494.44 | J/mol×K | 657.86 | Joback Calculated Property |
| Cp,gas | 510.73 | J/mol×K | 692.40 | Joback Calculated Property |
| Cp,gas | 526.25 | J/mol×K | 726.95 | Joback Calculated Property |
| Cp,gas | 541.10 | J/mol×K | 761.49 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to endo-Pinocampheol, acetate.
Sources
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