![Cyclohexanone, 6-[(butylthio)methylene]-2,2-diphenyl-](/cid/34-692-6/Cyclohexanone-6-butylthio-methylene-2-2-diphenyl.png "Cyclohexanone, 6-[(butylthio)methylene]-2,2-diphenyl-")
- InChI
- InChI=1S/C23H26OS/c1-2-3-17-25-18-19-11-10-16-23(22(19)24,20-12-6-4-7-13-20)21-14-8-5-9-15-21/h4-9,12-15,18H,2-3,10-11,16-17H2,1H3/b19-18-
- InChI Key
- DJPZTHCPTYZSHM-HNENSFHCSA-N
- Formula
- C23H26OS
- SMILES
-
CCCCSC=C1CCCC(c2ccccc2)(c2cccc
c2)C1=O - Molecular Weight1
- 350.52
- CAS
- 50592-51-3
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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 | 0.5732 | Relay (1.0) Calculated Property | |
| ΔfG° | 342.55 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 45.98 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 32.91 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 102.21 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.64 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.38 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.143 | Crippen Calculated Property | |
| McVol | 290.170 | ml/mol | McGowan Calculated Property |
| Pc | 1689.34 | kPa | Joback Calculated Property |
| Tboil | 689.82 | K | Relay (1.0) Calculated Property |
| Tc | 955.42 | K | Relay (1.0) Calculated Property |
| Tfus | 382.67 | K | Relay (1.0) Calculated Property |
| Vc | 0.972 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [925.63; 1049.33] | J/mol×K | [942.03; 1212.32] | 
|
| Cp,gas | 925.63 | J/mol×K | 942.03 | Joback Calculated Property |
| Cp,gas | 947.01 | J/mol×K | 987.08 | Joback Calculated Property |
| Cp,gas | 967.74 | J/mol×K | 1032.13 | Joback Calculated Property |
| Cp,gas | 988.07 | J/mol×K | 1077.18 | Joback Calculated Property |
| Cp,gas | 1008.27 | J/mol×K | 1122.22 | Joback Calculated Property |
| Cp,gas | 1028.60 | J/mol×K | 1167.27 | Joback Calculated Property |
| Cp,gas | 1049.33 | J/mol×K | 1212.32 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Cyclohexanone, 6-[(butylthio)methylene]-2,2-diphenyl-.
Sources
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