- InChI
- InChI=1S/C10H18O/c1-7(2)9-5-4-8(3)6-10(9)11/h8,10-11H,4-6H2,1-3H3
- InChI Key
- JGVWYJDASSSGEK-UHFFFAOYSA-N
- Formula
- C10H18O
- SMILES
- CC(C)=C1CCC(C)CC1O
- Molecular Weight1
- 154.25
- 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° | -49.85 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -301.74 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 17.66 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 55.52 | kJ/mol | Joback Calculated Property |
| log10WS | -2.89 | Crippen Calculated Property | |
| logPoct/wat | 2.504 | Crippen Calculated Property | |
| McVol | 142.470 | ml/mol | McGowan Calculated Property |
| Pc | 2829.33 | kPa | Joback Calculated Property |
| Inp | [1154.00; 1171.00] |
|
|
| Inp | 1168.00 | NIST | |
| Inp | 1166.00 | NIST | |
| Inp | 1171.00 | NIST | |
| Inp | 1154.00 | NIST | |
| Inp | 1168.00 | NIST | |
| Inp | 1154.00 | NIST | |
| I | [1614.00; 1614.00] |
|
|
| I | 1614.00 | NIST | |
| I | 1614.00 | NIST | |
| Tboil | 541.78 | K | Joback Calculated Property |
| Tc | 736.93 | K | Joback Calculated Property |
| Tfus | 262.82 | K | Joback Calculated Property |
| Vc | 0.530 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [351.40; 435.72] | J/mol×K | [541.78; 736.93] |
|
| Cp,gas | 351.40 | J/mol×K | 541.78 | Joback Calculated Property |
| Cp,gas | 367.35 | J/mol×K | 574.31 | Joback Calculated Property |
| Cp,gas | 382.51 | J/mol×K | 606.83 | Joback Calculated Property |
| Cp,gas | 396.91 | J/mol×K | 639.36 | Joback Calculated Property |
| Cp,gas | 410.57 | J/mol×K | 671.88 | Joback Calculated Property |
| Cp,gas | 423.50 | J/mol×K | 704.41 | Joback Calculated Property |
| Cp,gas | 435.72 | J/mol×K | 736.93 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to neoiso(iso)pulegol.
Sources
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