- InChI
- InChI=1S/C22H22O/c1-16(18-9-5-3-6-10-18)20-13-14-22(23)21(15-20)17(2)19-11-7-4-8-12-19/h3-17,23H,1-2H3
- InChI Key
- RCFAHSGZAAFQJH-UHFFFAOYSA-N
- Formula
- C22H22O
- SMILES
-
CC(c1ccccc1)c1ccc(O)c(C(C)c2cc
ccc2)c1 - Molecular Weight1
- 302.41
- CAS
- 2769-94-0
- Other Names
-
- 2,4-bis(1-phenylethyl)phenol
- 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° | 302.46 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 12.84 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 33.21 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 84.29 | kJ/mol | Joback Calculated Property |
| log10WS | -5.99 | Crippen Calculated Property | |
| logPoct/wat | 5.696 | Crippen Calculated Property | |
| McVol | 255.430 | ml/mol | McGowan Calculated Property |
| Pc | 2090.75 | kPa | Joback Calculated Property |
| Inp | 2426.00 | NIST | |
| Tboil | 867.52 | K | Joback Calculated Property |
| Tc | 1128.60 | K | Joback Calculated Property |
| Tfus | 511.20 | K | Joback Calculated Property |
| Vc | 0.897 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [770.05; 861.52] | J/mol×K | [867.52; 1128.60] | 
|
| Cp,gas | 770.05 | J/mol×K | 867.52 | Joback Calculated Property |
| Cp,gas | 787.19 | J/mol×K | 911.03 | Joback Calculated Property |
| Cp,gas | 803.28 | J/mol×K | 954.55 | Joback Calculated Property |
| Cp,gas | 818.55 | J/mol×K | 998.06 | Joback Calculated Property |
| Cp,gas | 833.20 | J/mol×K | 1041.57 | Joback Calculated Property |
| Cp,gas | 847.45 | J/mol×K | 1085.09 | Joback Calculated Property |
| Cp,gas | 861.52 | J/mol×K | 1128.60 | Joback Calculated Property |
| η | [0.0000032; 0.0001813] | Pa×s | [511.20; 867.52] |
|
| η | 0.0001813 | Pa×s | 511.20 | Joback Calculated Property |
| η | 0.0000652 | Pa×s | 570.59 | Joback Calculated Property |
| η | 0.0000285 | Pa×s | 629.97 | Joback Calculated Property |
| η | 0.0000143 | Pa×s | 689.36 | Joback Calculated Property |
| η | 0.0000080 | Pa×s | 748.75 | Joback Calculated Property |
| η | 0.0000049 | Pa×s | 808.13 | Joback Calculated Property |
| η | 0.0000032 | Pa×s | 867.52 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Phenol, 2,4-bis(1-phenylethyl)-.
Sources
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