- InChI
- InChI=1S/C10H18O/c1-5-9(4)8-10(11,6-2)7-3/h2,9,11H,5,7-8H2,1,3-4H3
- InChI Key
- FMLRBVOUYLRDRV-UHFFFAOYSA-N
- Formula
- C10H18O
- SMILES
- C#CC(O)(CC)CC(C)CC
- Molecular Weight1
- 154.25
- CAS
- 207974-16-1
- 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).
- 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° | 119.97 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -124.09 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 17.78 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 52.71 | kJ/mol | Joback Calculated Property |
| log10WS | -2.94 | Crippen Calculated Property | |
| logPoct/wat | 2.197 | Crippen Calculated Property | |
| McVol | 149.030 | ml/mol | McGowan Calculated Property |
| Pc | 2738.28 | kPa | Joback Calculated Property |
| Tboil | 506.83 | K | Joback Calculated Property |
| Tc | 687.22 | K | Joback Calculated Property |
| Tfus | 297.67 | K | Joback Calculated Property |
| Vc | 0.559 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [348.20; 418.12] | J/mol×K | [506.83; 687.22] | 
|
| Cp,gas | 348.20 | J/mol×K | 506.83 | Joback Calculated Property |
| Cp,gas | 361.50 | J/mol×K | 536.89 | Joback Calculated Property |
| Cp,gas | 374.09 | J/mol×K | 566.96 | Joback Calculated Property |
| Cp,gas | 386.01 | J/mol×K | 597.02 | Joback Calculated Property |
| Cp,gas | 397.30 | J/mol×K | 627.09 | Joback Calculated Property |
| Cp,gas | 407.99 | J/mol×K | 657.15 | Joback Calculated Property |
| Cp,gas | 418.12 | J/mol×K | 687.22 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3-Ethyl-5-methyl-1-heptyn-3-ol.
Sources
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