- InChI
- InChI=1S/C22H40O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17-20-23-22-19-16-18-21-24-22/h22H,2-9,12-21H2,1H3
- InChI Key
- ONANHJGDQJCYMD-UHFFFAOYSA-N
- Formula
- C22H40O2
- SMILES
- CCCCCCCCCC#CCCCCCCOC1CCCCO1
- Molecular Weight1
- 336.55
- CAS
- 56599-50-9
- 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° | 170.49 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -435.01 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 56.86 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 74.07 | kJ/mol | Joback Calculated Property |
| log10WS | -7.50 | Crippen Calculated Property | |
| logPoct/wat | 6.624 | Crippen Calculated Property | |
| McVol | 313.120 | ml/mol | McGowan Calculated Property |
| Pc | 1117.81 | kPa | Joback Calculated Property |
| Tboil | 780.68 | K | Joback Calculated Property |
| Tc | 973.22 | K | Joback Calculated Property |
| Tfus | 499.98 | K | Joback Calculated Property |
| Vc | 1.202 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [990.56; 1103.80] | J/mol×K | [780.68; 973.22] | 
|
| Cp,gas | 990.56 | J/mol×K | 780.68 | Joback Calculated Property |
| Cp,gas | 1012.45 | J/mol×K | 812.77 | Joback Calculated Property |
| Cp,gas | 1033.09 | J/mol×K | 844.86 | Joback Calculated Property |
| Cp,gas | 1052.51 | J/mol×K | 876.95 | Joback Calculated Property |
| Cp,gas | 1070.74 | J/mol×K | 909.04 | Joback Calculated Property |
| Cp,gas | 1087.83 | J/mol×K | 941.13 | Joback Calculated Property |
| Cp,gas | 1103.80 | J/mol×K | 973.22 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2H-Pyran, 2-(7-heptadecynyloxy)tetrahydro-.
Sources
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