- InChI
- InChI=1S/C21H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-16-20(22)18-21(23)17-19/h7-8,16-18,22-23H,2-6,9-15H2,1H3/b8-7-
- InChI Key
- TUGAUFMQYWZJAB-FPLPWBNLSA-N
- Formula
- C21H34O2
- SMILES
- CCCCCCC=CCCCCCCCc1cc(O)cc(O)c1
- Molecular Weight1
- 318.49
- CAS
- 22910-86-7
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- 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° | 9.33 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -477.64 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 55.95 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 90.60 | kJ/mol | Joback Calculated Property |
| log10WS | -6.67 | Crippen Calculated Property | |
| logPoct/wat | 6.508 | Crippen Calculated Property | |
| McVol | 290.430 | ml/mol | McGowan Calculated Property |
| Pc | 1534.26 | kPa | Joback Calculated Property |
| Inp | [2788.30; 2788.30] |
|
|
| Inp | 2788.30 | NIST | |
| Inp | 2788.30 | NIST | |
| Tboil | 871.96 | K | Joback Calculated Property |
| Tc | 1080.84 | K | Joback Calculated Property |
| Tfus | 571.21 | K | Joback Calculated Property |
| Vc | 1.016 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [934.32; 1038.29] | J/mol×K | [871.96; 1080.84] |
|
| Cp,gas | 934.32 | J/mol×K | 871.96 | Joback Calculated Property |
| Cp,gas | 952.22 | J/mol×K | 906.77 | Joback Calculated Property |
| Cp,gas | 969.70 | J/mol×K | 941.59 | Joback Calculated Property |
| Cp,gas | 986.89 | J/mol×K | 976.40 | Joback Calculated Property |
| Cp,gas | 1003.96 | J/mol×K | 1011.21 | Joback Calculated Property |
| Cp,gas | 1021.05 | J/mol×K | 1046.02 | Joback Calculated Property |
| Cp,gas | 1038.29 | J/mol×K | 1080.84 | Joback Calculated Property |
| η | [0.0000002; 0.0000136] | Pa×s | [571.21; 871.96] |
|
| η | 0.0000136 | Pa×s | 571.21 | Joback Calculated Property |
| η | 0.0000048 | Pa×s | 621.34 | Joback Calculated Property |
| η | 0.0000020 | Pa×s | 671.46 | Joback Calculated Property |
| η | 0.0000009 | Pa×s | 721.59 | Joback Calculated Property |
| η | 0.0000005 | Pa×s | 771.71 | Joback Calculated Property |
| η | 0.0000003 | Pa×s | 821.84 | Joback Calculated Property |
| η | 0.0000002 | Pa×s | 871.96 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to (Z)-5-(Pentadec-8-en-1-yl)benzene-1,3-diol.
Sources
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