- InChI
- InChI=1S/C20H18O3/c1-20(14-2-8-17(21)9-3-14,15-4-10-18(22)11-5-15)16-6-12-19(23)13-7-16/h2-13,21-23H,1H3
- InChI Key
- BRPSWMCDEYMRPE-UHFFFAOYSA-N
- Formula
- C20H18O3
- SMILES
-
CC(c1ccc(O)cc1)(c1ccc(O)cc1)c1
ccc(O)cc1 - Molecular Weight1
- 306.36
- CAS
- 27955-94-8
- Other Names
-
- 1,1,1-Tris(4-hydroxyphenyl)ethane
- 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).
- 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° | -6.27 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -287.22 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 39.61 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 104.69 | kJ/mol | Joback Calculated Property |
| log10WS | -4.03 | Crippen Calculated Property | |
| logPoct/wat | 4.158 | Crippen Calculated Property | |
| McVol | 238.990 | ml/mol | McGowan Calculated Property |
| Pc | 3547.31 | kPa | Joback Calculated Property |
| Tboil | 975.67 | K | Joback Calculated Property |
| Tc | 1259.62 | K | Joback Calculated Property |
| Tfus | 732.00 | K | Joback Calculated Property |
| Vc | 0.719 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [755.11; 892.40] | J/mol×K | [975.67; 1259.62] | 
|
| Cp,gas | 755.11 | J/mol×K | 975.67 | Joback Calculated Property |
| Cp,gas | 773.23 | J/mol×K | 1022.99 | Joback Calculated Property |
| Cp,gas | 792.60 | J/mol×K | 1070.32 | Joback Calculated Property |
| Cp,gas | 813.71 | J/mol×K | 1117.64 | Joback Calculated Property |
| Cp,gas | 837.06 | J/mol×K | 1164.97 | Joback Calculated Property |
| Cp,gas | 863.12 | J/mol×K | 1212.29 | Joback Calculated Property |
| Cp,gas | 892.40 | J/mol×K | 1259.62 | Joback Calculated Property |
| η | [3.5395230e-09; 0.0000001] | Pa×s | [732.00; 975.67] |
|
| η | 0.0000001 | Pa×s | 732.00 | Joback Calculated Property |
| η | 5.3375019e-08 | Pa×s | 772.61 | Joback Calculated Property |
| η | 2.7834347e-08 | Pa×s | 813.22 | Joback Calculated Property |
| η | 1.5442657e-08 | Pa×s | 853.84 | Joback Calculated Property |
| η | 9.0385175e-09 | Pa×s | 894.45 | Joback Calculated Property |
| η | 5.5421618e-09 | Pa×s | 935.06 | Joback Calculated Property |
| η | 3.5395230e-09 | Pa×s | 975.67 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Phenol, 4,4',4''-ethylidynetris-.
Sources
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