- InChI
- InChI=1S/C10H18O2/c1-9-5-3-8(4-6-9)10(2,7-11)12-9/h8,11H,3-7H2,1-2H3/t8?,9-,10-/m0/s1
- InChI Key
- HTGSXANWVMWFEM-AGROOBSYSA-N
- Formula
- C10H18O2
- SMILES
- CC12CCC(CC1)C(C)(CO)O2
- Molecular Weight1
- 170.25
- 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° | -111.01 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -390.54 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 14.27 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 56.60 | kJ/mol | Joback Calculated Property |
| log10WS | -2.13 | Crippen Calculated Property | |
| logPoct/wat | 1.717 | Crippen Calculated Property | |
| McVol | 141.780 | ml/mol | McGowan Calculated Property |
| Pc | 3348.98 | kPa | Joback Calculated Property |
| Inp | [1267.00; 1340.00] |
|
|
| Inp | 1340.00 | NIST | |
| Inp | 1267.00 | NIST | |
| I | 2091.00 | NIST | |
| Tboil | 565.16 | K | Joback Calculated Property |
| Tc | 771.88 | K | Joback Calculated Property |
| Tfus | 362.25 | K | Joback Calculated Property |
| Vc | 0.528 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [385.13; 466.66] | J/mol×K | [565.16; 771.88] |
|
| Cp,gas | 385.13 | J/mol×K | 565.16 | Joback Calculated Property |
| Cp,gas | 400.59 | J/mol×K | 599.61 | Joback Calculated Property |
| Cp,gas | 415.03 | J/mol×K | 634.07 | Joback Calculated Property |
| Cp,gas | 428.66 | J/mol×K | 668.52 | Joback Calculated Property |
| Cp,gas | 441.67 | J/mol×K | 702.98 | Joback Calculated Property |
| Cp,gas | 454.27 | J/mol×K | 737.43 | Joback Calculated Property |
| Cp,gas | 466.66 | J/mol×K | 771.88 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 9-hydroxy-1,8-cineole.
Sources
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