- InChI
- InChI=1S/C13H18O/c1-12(2)7-4-5-10-9-13(3,14)8-6-11(10)12/h4-6,8,14H,7,9H2,1-3H3
- InChI Key
- SNOSJZMPQDGXOX-UHFFFAOYSA-N
- Formula
- C13H18O
- SMILES
- CC1(O)C=CC2=C(C=CCC2(C)C)C1
- Molecular Weight1
- 190.28
- 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).
- 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° | 54.50 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -162.04 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 11.68 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 61.62 | kJ/mol | Joback Calculated Property |
| log10WS | -3.75 | Crippen Calculated Property | |
| logPoct/wat | 2.980 | Crippen Calculated Property | |
| McVol | 165.280 | ml/mol | McGowan Calculated Property |
| Pc | 2934.52 | kPa | Joback Calculated Property |
| I | [1973.00; 1973.00] |
|
|
| I | 1973.00 | NIST | |
| I | 1973.00 | NIST | |
| Tboil | 627.50 | K | Joback Calculated Property |
| Tc | 847.44 | K | Joback Calculated Property |
| Tfus | 394.01 | K | Joback Calculated Property |
| Vc | 0.619 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [440.06; 525.33] | J/mol×K | [627.50; 847.44] |
|
| Cp,gas | 440.06 | J/mol×K | 627.50 | Joback Calculated Property |
| Cp,gas | 455.41 | J/mol×K | 664.16 | Joback Calculated Property |
| Cp,gas | 469.99 | J/mol×K | 700.81 | Joback Calculated Property |
| Cp,gas | 484.04 | J/mol×K | 737.47 | Joback Calculated Property |
| Cp,gas | 497.79 | J/mol×K | 774.13 | Joback Calculated Property |
| Cp,gas | 511.48 | J/mol×K | 810.78 | Joback Calculated Property |
| Cp,gas | 525.33 | J/mol×K | 847.44 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 6-Hydroxy-1,1,6-trimethyl-1,2,5,6-tetrahydronaphthalene.
Sources
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