- InChI
- InChI=1S/C22H38/c1-3-4-5-6-7-8-9-10-11-12-13-15-18-21(2)22-19-16-14-17-20-22/h14,16-17,19-21H,3-13,15,18H2,1-2H3
- InChI Key
- ZUXDORPHXZKYTN-UHFFFAOYSA-N
- Formula
- C22H38
- SMILES
- CCCCCCCCCCCCCCC(C)c1ccccc1
- Molecular Weight1
- 302.54
- CAS
- 13419-16-4
- Other Names
-
- Hexadecane, 2-phenyl-
- 2-phenylhexadecane
- 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° | 244.33 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -266.16 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 43.25 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 66.45 | kJ/mol | Joback Calculated Property |
| log10WS | -8.10 | Crippen Calculated Property | |
| logPoct/wat | 7.881 | Crippen Calculated Property | |
| McVol | 297.080 | ml/mol | McGowan Calculated Property |
| Pc | 1117.81 | kPa | Joback Calculated Property |
| Tboil | 729.00 | K | Joback Calculated Property |
| Tc | 913.46 | K | Joback Calculated Property |
| Tfus | 349.12 | K | Joback Calculated Property |
| Vc | 1.153 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [885.61; 995.86] | J/mol×K | [729.00; 913.46] | 
|
| Cp,gas | 885.61 | J/mol×K | 729.00 | Joback Calculated Property |
| Cp,gas | 906.56 | J/mol×K | 759.74 | Joback Calculated Property |
| Cp,gas | 926.42 | J/mol×K | 790.49 | Joback Calculated Property |
| Cp,gas | 945.23 | J/mol×K | 821.23 | Joback Calculated Property |
| Cp,gas | 963.04 | J/mol×K | 851.97 | Joback Calculated Property |
| Cp,gas | 979.90 | J/mol×K | 882.72 | Joback Calculated Property |
| Cp,gas | 995.86 | J/mol×K | 913.46 | Joback Calculated Property |
| η | [0.0000704; 0.0027423] | Pa×s | [349.12; 729.00] |
|
| η | 0.0027423 | Pa×s | 349.12 | Joback Calculated Property |
| η | 0.0009325 | Pa×s | 412.43 | Joback Calculated Property |
| η | 0.0004225 | Pa×s | 475.75 | Joback Calculated Property |
| η | 0.0002306 | Pa×s | 539.06 | Joback Calculated Property |
| η | 0.0001429 | Pa×s | 602.37 | Joback Calculated Property |
| η | 0.0000970 | Pa×s | 665.69 | Joback Calculated Property |
| η | 0.0000704 | Pa×s | 729.00 | Joback Calculated Property |
Similar Compounds
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Sources
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