- InChI
- InChI=1S/C11H12O/c12-11(10-7-4-8-10)9-5-2-1-3-6-9/h1-3,5-6,10H,4,7-8H2
- InChI Key
- MVEBDOSCXOQNAR-UHFFFAOYSA-N
- Formula
- C11H12O
- SMILES
- O=C(c1ccccc1)C1CCC1
- Molecular Weight1
- 160.21
- CAS
- 5407-98-7
- Other Names
-
- Benzoylcyclobutane
- Methanone, (cyclobutyl)(phenyl)-
- 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).
- Tboilr : Boiling point at reduced pressure (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 | 0.4234 | Relay (1.0) Calculated Property | |
| ΔfG° | 73.88 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -67.05 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 15.92 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 68.74 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.14 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.01 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.669 | Crippen Calculated Property | |
| McVol | 132.800 | ml/mol | McGowan Calculated Property |
| Pc | 3360.64 | kPa | Joback Calculated Property |
| Tboil | [533.00; 533.20] | K |
|
| Tboil | 533.20 | K | NIST |
| Tboil | 533.00 | K | NIST |
| Tc | 773.52 | K | Relay (1.0) Calculated Property |
| Tfus | 298.67 | K | Relay (1.0) Calculated Property |
| Vc | 0.482 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [307.56; 390.28] | J/mol×K | [542.64; 779.21] |
|
| Cp,gas | 307.56 | J/mol×K | 542.64 | Joback Calculated Property |
| Cp,gas | 324.22 | J/mol×K | 582.07 | Joback Calculated Property |
| Cp,gas | 339.63 | J/mol×K | 621.50 | Joback Calculated Property |
| Cp,gas | 353.86 | J/mol×K | 660.93 | Joback Calculated Property |
| Cp,gas | 367.00 | J/mol×K | 700.35 | Joback Calculated Property |
| Cp,gas | 379.11 | J/mol×K | 739.78 | Joback Calculated Property |
| Cp,gas | 390.28 | J/mol×K | 779.21 | Joback Calculated Property |
| η | [0.0004189; 0.0028214] | Pa×s | [304.50; 542.64] |
|
| η | 0.0028214 | Pa×s | 304.50 | Joback Calculated Property |
| η | 0.0017093 | Pa×s | 344.19 | Joback Calculated Property |
| η | 0.0011486 | Pa×s | 383.88 | Joback Calculated Property |
| η | 0.0008315 | Pa×s | 423.57 | Joback Calculated Property |
| η | 0.0006363 | Pa×s | 463.26 | Joback Calculated Property |
| η | 0.0005079 | Pa×s | 502.95 | Joback Calculated Property |
| η | 0.0004189 | Pa×s | 542.64 | Joback Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | [389.20; 405.00] | K | [0.90; 2.00] |
|
| Tboilr | 389.20 | K | 0.90 | NIST |
| Tboilr | 405.00 ± 1.00 | K | 2.00 | NIST |
Similar Compounds
Find more compounds similar to Cyclobutyl phenyl ketone.
Sources
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