- InChI
- InChI=1S/C26H34/c1-2-3-4-5-6-7-8-9-10-11-16-22-21-23-17-12-13-18-24(23)26-20-15-14-19-25(22)26/h12-15,17-21H,2-11,16H2,1H3
- InChI Key
- QBNLPAPGLLSKBN-UHFFFAOYSA-N
- Formula
- C26H34
- SMILES
-
CCCCCCCCCCCCc1cc2ccccc2c2ccccc
12 - Molecular Weight1
- 346.55
- CAS
- 3788-61-2
- Other Names
-
- 9-n-Dodecylphenanthrene
- 9-Dodecylphenathrene
- 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).
- ΔvapH : Enthalpy of vaporization at a given temperature (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° | 474.49 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 15.76 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 50.40 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 80.35 | kJ/mol | Joback Calculated Property |
| log10WS | -10.07 | Crippen Calculated Property | |
| logPoct/wat | 8.456 | Crippen Calculated Property | |
| McVol | 314.520 | ml/mol | McGowan Calculated Property |
| Pc | 1170.42 | kPa | Joback Calculated Property |
| Tboil | 868.88 | K | Joback Calculated Property |
| Tc | 1081.32 | K | Joback Calculated Property |
| Tfus | 348.95 ± 0.50 | K | NIST |
| Vc | 1.228 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [989.60; 1090.04] | J/mol×K | [868.88; 1081.32] | 
|
| Cp,gas | 989.60 | J/mol×K | 868.88 | Joback Calculated Property |
| Cp,gas | 1008.32 | J/mol×K | 904.29 | Joback Calculated Property |
| Cp,gas | 1026.10 | J/mol×K | 939.69 | Joback Calculated Property |
| Cp,gas | 1043.04 | J/mol×K | 975.10 | Joback Calculated Property |
| Cp,gas | 1059.27 | J/mol×K | 1010.51 | Joback Calculated Property |
| Cp,gas | 1074.90 | J/mol×K | 1045.91 | Joback Calculated Property |
| Cp,gas | 1090.04 | J/mol×K | 1081.32 | Joback Calculated Property |
| η | [0.0001824; 0.0010828] | Pa×s | [499.64; 868.88] |
|
| η | 0.0010828 | Pa×s | 499.64 | Joback Calculated Property |
| η | 0.0006838 | Pa×s | 561.18 | Joback Calculated Property |
| η | 0.0004729 | Pa×s | 622.72 | Joback Calculated Property |
| η | 0.0003494 | Pa×s | 684.26 | Joback Calculated Property |
| η | 0.0002715 | Pa×s | 745.80 | Joback Calculated Property |
| η | 0.0002191 | Pa×s | 807.34 | Joback Calculated Property |
| η | 0.0001824 | Pa×s | 868.88 | Joback Calculated Property |
| ΔvapH | 95.70 | kJ/mol | 531.50 | NIST |
Similar Compounds
Find more compounds similar to Phenanthrene, 9-dodecyl-.
Sources
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