- InChI
- InChI=1S/C11H20O/c1-3-5-6-7-8-10-11(12)9-4-2/h2,11-12H,3,5-10H2,1H3
- InChI Key
- IBEKWLNDNQDLQS-UHFFFAOYSA-N
- Formula
- C11H20O
- SMILES
- C#CCC(O)CCCCCCC
- Molecular Weight1
- 168.28
- CAS
- 22127-86-2
- 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.
- 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° | 125.55 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -135.98 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 27.79 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 56.23 | kJ/mol | Joback Calculated Property |
| log10WS | -3.60 | Crippen Calculated Property | |
| logPoct/wat | 2.731 | Crippen Calculated Property | |
| McVol | 163.120 | ml/mol | McGowan Calculated Property |
| Pc | 2436.25 | kPa | Joback Calculated Property |
| Inp | [1107.00; 1107.00] |
|
|
| Inp | 1107.00 | NIST | |
| Inp | 1107.00 | NIST | |
| Tboil | 532.94 | K | Joback Calculated Property |
| Tc | 702.37 | K | Joback Calculated Property |
| Tfus | 306.52 | K | Joback Calculated Property |
| Vc | 0.626 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [391.18; 462.05] | J/mol×K | [532.94; 702.37] |
|
| Cp,gas | 391.18 | J/mol×K | 532.94 | Joback Calculated Property |
| Cp,gas | 404.34 | J/mol×K | 561.18 | Joback Calculated Property |
| Cp,gas | 416.94 | J/mol×K | 589.42 | Joback Calculated Property |
| Cp,gas | 428.99 | J/mol×K | 617.66 | Joback Calculated Property |
| Cp,gas | 440.51 | J/mol×K | 645.89 | Joback Calculated Property |
| Cp,gas | 451.52 | J/mol×K | 674.13 | Joback Calculated Property |
| Cp,gas | 462.05 | J/mol×K | 702.37 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1-Undecyn-4-ol.
Sources
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