- InChI
- InChI=1S/C13H22O/c1-10-4-11(2)6-12(3,5-10)9-13(14,7-10)8-11/h14H,4-9H2,1-3H3
- InChI Key
- DVKFVAJDHKVYLK-UHFFFAOYSA-N
- Formula
- C13H22O
- SMILES
- CC12CC3(C)CC(C)(C1)CC(O)(C2)C3
- Molecular Weight1
- 194.31
- 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° | 62.24 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -211.02 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 1.70 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 56.21 | kJ/mol | Joback Calculated Property |
| log10WS | -3.60 | Crippen Calculated Property | |
| logPoct/wat | 3.118 | Crippen Calculated Property | |
| McVol | 167.320 | ml/mol | McGowan Calculated Property |
| Pc | 3045.68 | kPa | Joback Calculated Property |
| Inp | [1304.00; 1344.00] |
|
|
| Inp | 1304.00 | NIST | |
| Inp | 1322.00 | NIST | |
| Inp | 1335.00 | NIST | |
| Inp | 1344.00 | NIST | |
| Inp | 1304.00 | NIST | |
| I | [1785.00; 1816.00] |
|
|
| I | 1785.00 | NIST | |
| I | 1801.00 | NIST | |
| I | 1816.00 | NIST | |
| I | 1785.00 | NIST | |
| Tboil | 609.80 | K | Joback Calculated Property |
| Tc | 831.80 | K | Joback Calculated Property |
| Tfus | 438.75 | K | Joback Calculated Property |
| Vc | 0.636 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [482.73; 580.73] | J/mol×K | [609.80; 831.80] |
|
| Cp,gas | 482.73 | J/mol×K | 609.80 | Joback Calculated Property |
| Cp,gas | 499.70 | J/mol×K | 646.80 | Joback Calculated Property |
| Cp,gas | 515.77 | J/mol×K | 683.80 | Joback Calculated Property |
| Cp,gas | 531.43 | J/mol×K | 720.80 | Joback Calculated Property |
| Cp,gas | 547.16 | J/mol×K | 757.80 | Joback Calculated Property |
| Cp,gas | 563.43 | J/mol×K | 794.80 | Joback Calculated Property |
| Cp,gas | 580.73 | J/mol×K | 831.80 | Joback Calculated Property |
Similar Compounds
![Bicyclo[2.2.2]octan-1-ol, 4-methyl-.](data:image/png;base64,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)
Find more compounds similar to 3,5,7-trimethyl-1-adamantanol.
Sources
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