- InChI
- InChI=1S/C16H12O/c1-11(17)13-8-9-16-14(10-13)7-6-12-4-2-3-5-15(12)16/h2-10H,1H3
- InChI Key
- CWILMKDSVMROHT-UHFFFAOYSA-N
- Formula
- C16H12O
- SMILES
- CC(=O)c1ccc2c(ccc3ccccc32)c1
- Molecular Weight1
- 220.27
- Other Names
-
- 1-(2-Phenanthryl)ethanone
- Ethanone, 1-(2-phenanthrenyl)-
- Methyl 2-phenanthryl ketone
- NSC 402640
- ω : Acentric Factor.
- 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).
- 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 |
|---|---|---|---|
| ω | 0.5746 | Relay (1.0) Calculated Property | |
| ΔfG° | 261.37 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 23.99 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 26.10 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 100.83 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.06 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.98 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.196 | Crippen Calculated Property | |
| McVol | 175.190 | ml/mol | McGowan Calculated Property |
| Pc | 2770.08 | kPa | Joback Calculated Property |
| Tboil | 674.40 | K | Relay (1.0) Calculated Property |
| Tc | 962.61 | K | Relay (1.0) Calculated Property |
| Tfus | 389.54 | K | Relay (1.0) Calculated Property |
| Vc | 0.650 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [445.26; 515.09] | J/mol×K | [694.15; 943.75] | 
|
| Cp,gas | 445.26 | J/mol×K | 694.15 | Joback Calculated Property |
| Cp,gas | 459.21 | J/mol×K | 735.75 | Joback Calculated Property |
| Cp,gas | 472.06 | J/mol×K | 777.35 | Joback Calculated Property |
| Cp,gas | 483.94 | J/mol×K | 818.95 | Joback Calculated Property |
| Cp,gas | 494.98 | J/mol×K | 860.55 | Joback Calculated Property |
| Cp,gas | 505.32 | J/mol×K | 902.15 | Joback Calculated Property |
| Cp,gas | 515.09 | J/mol×K | 943.75 | Joback Calculated Property |
| η | [0.0004911; 0.0016094] | Pa×s | [436.87; 694.15] |
|
| η | 0.0016094 | Pa×s | 436.87 | Joback Calculated Property |
| η | 0.0012088 | Pa×s | 479.75 | Joback Calculated Property |
| η | 0.0009516 | Pa×s | 522.63 | Joback Calculated Property |
| η | 0.0007768 | Pa×s | 565.51 | Joback Calculated Property |
| η | 0.0006525 | Pa×s | 608.39 | Joback Calculated Property |
| η | 0.0005608 | Pa×s | 651.27 | Joback Calculated Property |
| η | 0.0004911 | Pa×s | 694.15 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Acetylphenanthrene.
Sources
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