- InChI
- InChI=1S/C30H22/c1-5-13-23(14-6-1)27-21-28(24-15-7-2-8-16-24)30(26-19-11-4-12-20-26)29(22-27)25-17-9-3-10-18-25/h1-22H
- InChI Key
- SKTCWUHHHPSBCJ-UHFFFAOYSA-N
- Formula
- C30H22
- SMILES
-
c1ccc(-c2cc(-c3ccccc3)c(-c3ccc
cc3)c(-c3ccccc3)c2)cc1 - Molecular Weight1
- 382.50
- CAS
- 912-61-8
- 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° | 734.88 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 485.71 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 42.49 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 95.74 | kJ/mol | Joback Calculated Property |
| log10WS | -11.88 | Crippen Calculated Property | |
| logPoct/wat | 8.355 | Crippen Calculated Property | |
| McVol | 314.760 | ml/mol | McGowan Calculated Property |
| Pc | 1615.47 | kPa | Joback Calculated Property |
| Tboil | 1034.14 | K | Joback Calculated Property |
| Tc | 1323.15 | K | Joback Calculated Property |
| Tfus | 597.52 | K | Joback Calculated Property |
| Vc | 1.175 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [976.86; 1053.65] | J/mol×K | [1034.14; 1323.15] | 
|
| Cp,gas | 976.86 | J/mol×K | 1034.14 | Joback Calculated Property |
| Cp,gas | 991.89 | J/mol×K | 1082.31 | Joback Calculated Property |
| Cp,gas | 1005.67 | J/mol×K | 1130.48 | Joback Calculated Property |
| Cp,gas | 1018.47 | J/mol×K | 1178.64 | Joback Calculated Property |
| Cp,gas | 1030.55 | J/mol×K | 1226.81 | Joback Calculated Property |
| Cp,gas | 1042.19 | J/mol×K | 1274.98 | Joback Calculated Property |
| Cp,gas | 1053.65 | J/mol×K | 1323.15 | Joback Calculated Property |
| η | [0.0000317; 0.0002934] | Pa×s | [597.52; 1034.14] |
|
| η | 0.0002934 | Pa×s | 597.52 | Joback Calculated Property |
| η | 0.0001656 | Pa×s | 670.29 | Joback Calculated Property |
| η | 0.0001045 | Pa×s | 743.06 | Joback Calculated Property |
| η | 0.0000716 | Pa×s | 815.83 | Joback Calculated Property |
| η | 0.0000522 | Pa×s | 888.60 | Joback Calculated Property |
| η | 0.0000399 | Pa×s | 961.37 | Joback Calculated Property |
| η | 0.0000317 | Pa×s | 1034.14 | Joback Calculated Property |
Similar Compounds
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Sources
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