- InChI
- InChI=1S/C10H16O2/c1-9(2)5-4-10(3,8(9)11)7-6(5)12-7/h5-8,11H,4H2,1-3H3/t5-,6?,7?,8?,10+/m1/s1
- InChI Key
- ALYCMEVQHFCUJZ-OKEXLJTKSA-N
- Formula
- C10H16O2
- SMILES
- CC1(C)C2CC(C)(C3OC23)C1O
- Molecular Weight1
- 168.23
- 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° | -29.38 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -339.94 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 20.85 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 55.38 | kJ/mol | Joback Calculated Property |
| log10WS | -1.65 | Crippen Calculated Property | |
| logPoct/wat | 1.181 | Crippen Calculated Property | |
| McVol | 130.920 | ml/mol | McGowan Calculated Property |
| Pc | 3306.75 | kPa | Joback Calculated Property |
| Inp | [1101.00; 1101.00] |
|
|
| Inp | 1101.00 | NIST | |
| Inp | 1101.00 | NIST | |
| I | [1557.00; 1557.00] |
|
|
| I | 1557.00 | NIST | |
| I | 1557.00 | NIST | |
| Tboil | 549.75 | K | Joback Calculated Property |
| Tc | 749.77 | K | Joback Calculated Property |
| Tfus | 382.27 | K | Joback Calculated Property |
| Vc | 0.507 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [371.40; 446.87] | J/mol×K | [549.75; 749.77] |
|
| Cp,gas | 371.40 | J/mol×K | 549.75 | Joback Calculated Property |
| Cp,gas | 385.97 | J/mol×K | 583.09 | Joback Calculated Property |
| Cp,gas | 399.46 | J/mol×K | 616.42 | Joback Calculated Property |
| Cp,gas | 412.08 | J/mol×K | 649.76 | Joback Calculated Property |
| Cp,gas | 424.05 | J/mol×K | 683.09 | Joback Calculated Property |
| Cp,gas | 435.58 | J/mol×K | 716.43 | Joback Calculated Property |
| Cp,gas | 446.87 | J/mol×K | 749.77 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Fenchol, 2,3-epoxy, exo.
Sources
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