- InChI
- InChI=1S/C18H18/c1-11-7-13(3)17-15(9-11)5-6-16-10-12(2)8-14(4)18(16)17/h5-10H,1-4H3
- InChI Key
- BZXXZUAJRXKPOF-UHFFFAOYSA-N
- Formula
- C18H18
- SMILES
-
Cc1cc(C)c2c(ccc3cc(C)cc(C)c32)
c1 - Molecular Weight1
- 234.34
- CAS
- 7396-38-5
- Other Names
-
- 2,4,5,7-Tetramethylphenanthrene
- ΔcH°solid : Standard solid enthalpy of combustion (kJ/mol).
- 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).
- ΔfH°solid : Solid phase enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔsubH° : Enthalpy of sublimation at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ΔcH°solid | -9672.80 ± 2.30 | kJ/mol | NIST |
| ΔfG° | 378.24 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 130.00 ± 4.00 | kJ/mol | NIST |
| ΔfH°solid | 16.00 ± 3.00 | kJ/mol | NIST |
| ΔfusH° | 28.51 | kJ/mol | Joback Calculated Property |
| ΔsubH° | [114.00; 114.00] | kJ/mol |
|
| ΔsubH° | 114.00 ± 2.00 | kJ/mol | NIST |
| ΔsubH° | 114.00 | kJ/mol | NIST |
| ΔvapH° | 64.53 | kJ/mol | Joback Calculated Property |
| IE | 7.80 ± 0.10 | eV | NIST |
| log10WS | -6.98 | Crippen Calculated Property | |
| logPoct/wat | 5.227 | Crippen Calculated Property | |
| McVol | 201.800 | ml/mol | McGowan Calculated Property |
| Pc | 2066.12 | kPa | Joback Calculated Property |
| Tboil | 700.78 | K | Joback Calculated Property |
| Tc | 937.00 | K | Joback Calculated Property |
| Tfus | 447.04 | K | Joback Calculated Property |
| Vc | 0.779 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [530.75; 614.52] | J/mol×K | [700.78; 937.00] |
|
| Cp,gas | 530.75 | J/mol×K | 700.78 | Joback Calculated Property |
| Cp,gas | 546.98 | J/mol×K | 740.15 | Joback Calculated Property |
| Cp,gas | 562.17 | J/mol×K | 779.52 | Joback Calculated Property |
| Cp,gas | 576.42 | J/mol×K | 818.89 | Joback Calculated Property |
| Cp,gas | 589.83 | J/mol×K | 858.26 | Joback Calculated Property |
| Cp,gas | 602.50 | J/mol×K | 897.63 | Joback Calculated Property |
| Cp,gas | 614.52 | J/mol×K | 937.00 | Joback Calculated Property |
| η | [0.0003925; 0.0010269] | Pa×s | [447.04; 700.78] |
|
| η | 0.0010269 | Pa×s | 447.04 | Joback Calculated Property |
| η | 0.0008162 | Pa×s | 489.33 | Joback Calculated Property |
| η | 0.0006730 | Pa×s | 531.62 | Joback Calculated Property |
| η | 0.0005708 | Pa×s | 573.91 | Joback Calculated Property |
| η | 0.0004953 | Pa×s | 616.20 | Joback Calculated Property |
| η | 0.0004376 | Pa×s | 658.49 | Joback Calculated Property |
| η | 0.0003925 | Pa×s | 700.78 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Phenanthrene, 2,4,5,7-tetramethyl-.
Sources
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