- InChI
- InChI=1S/C10H16O/c1-2-10(11)8-6-4-3-5-7-9-10/h1,11H,3-9H2
- InChI Key
- DHAPUKCAOFQTIT-UHFFFAOYSA-N
- Formula
- C10H16O
- SMILES
- C#CC1(O)CCCCCCC1
- Molecular Weight1
- 152.23
- CAS
- 55373-76-7
- Other Names
-
- Cyclooctanol, 1-ethynyl-
- 1-Aethinyl-cyclooctanol-(1)
- 1-Ethynylcyclooctanol
- 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).
- Tboilr : Boiling point at reduced pressure (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° | 114.33 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -52.82 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 10.06 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 54.01 | kJ/mol | Joback Calculated Property |
| log10WS | -3.07 | Crippen Calculated Property | |
| logPoct/wat | 2.095 | Crippen Calculated Property | |
| McVol | 138.170 | ml/mol | McGowan Calculated Property |
| Pc | 3727.11 | kPa | Joback Calculated Property |
| Tboil | 538.83 | K | Joback Calculated Property |
| Tc | 760.81 | K | Joback Calculated Property |
| Tfus | 334.49 | K | Joback Calculated Property |
| Vc | 0.491 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [331.58; 418.69] | J/mol×K | [538.83; 760.81] | 
|
| Cp,gas | 331.58 | J/mol×K | 538.83 | Joback Calculated Property |
| Cp,gas | 348.47 | J/mol×K | 575.83 | Joback Calculated Property |
| Cp,gas | 364.26 | J/mol×K | 612.82 | Joback Calculated Property |
| Cp,gas | 379.07 | J/mol×K | 649.82 | Joback Calculated Property |
| Cp,gas | 392.99 | J/mol×K | 686.81 | Joback Calculated Property |
| Cp,gas | 406.16 | J/mol×K | 723.81 | Joback Calculated Property |
| Cp,gas | 418.69 | J/mol×K | 760.81 | Joback Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 378.00 ± 1.00 | K | 1.60 | NIST |
Similar Compounds
Find more compounds similar to 1-Ethynyl-1-cyclooctanol.
Sources
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