- InChI
- InChI=1S/C27H20O/c28-27(22-16-8-3-9-17-22)24-19-11-10-18-23(24)25(20-12-4-1-5-13-20)26(27)21-14-6-2-7-15-21/h1-19,28H
- InChI Key
- ADZZBNYBYSNNGJ-UHFFFAOYSA-N
- Formula
- C27H20O
- SMILES
-
OC1(c2ccccc2)C(c2ccccc2)=C(c2c
cccc2)c2ccccc21 - Molecular Weight1
- 360.45
- CAS
- 42454-94-4
- 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° | 545.61 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 304.69 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 37.83 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 102.52 | kJ/mol | Joback Calculated Property |
| log10WS | -7.22 | Crippen Calculated Property | |
| logPoct/wat | 5.895 | Crippen Calculated Property | |
| McVol | 286.960 | ml/mol | McGowan Calculated Property |
| Pc | 2014.51 | kPa | Joback Calculated Property |
| Tboil | 1037.14 | K | Joback Calculated Property |
| Tc | 1304.88 | K | Joback Calculated Property |
| Tfus | 640.71 | K | Joback Calculated Property |
| Vc | 1.075 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [920.89; 1075.91] | J/mol×K | [1037.14; 1304.88] | 
|
| Cp,gas | 920.89 | J/mol×K | 1037.14 | Joback Calculated Property |
| Cp,gas | 942.50 | J/mol×K | 1081.76 | Joback Calculated Property |
| Cp,gas | 965.27 | J/mol×K | 1126.39 | Joback Calculated Property |
| Cp,gas | 989.60 | J/mol×K | 1171.01 | Joback Calculated Property |
| Cp,gas | 1015.88 | J/mol×K | 1215.64 | Joback Calculated Property |
| Cp,gas | 1044.52 | J/mol×K | 1260.26 | Joback Calculated Property |
| Cp,gas | 1075.91 | J/mol×K | 1304.88 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Inden-1-ol, 1,2,3-triphenyl-.
Sources
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