![[1,1'-Bicyclohexyl]-2-one, 1'-hydroxy-](/cid/85-034-0/1-1-Bicyclohexyl-2-one-1-hydroxy.png "[1,1'-Bicyclohexyl]-2-one, 1'-hydroxy-")
- InChI
- InChI=1S/C12H20O2/c13-11-7-3-2-6-10(11)12(14)8-4-1-5-9-12/h10,14H,1-9H2
- InChI Key
- AERVJOBGBMEFDV-UHFFFAOYSA-N
- Formula
- C12H20O2
- SMILES
- O=C1CCCCC1C1(O)CCCCC1
- Molecular Weight1
- 196.29
- CAS
- 28746-99-8
- Other Names
-
- 1'-hydroxy-[1,1'-bicyclohexyl]-2-one
- 2-(1'-Hydroxycyclohexyl)cyclohexanone
- 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).
- ΔfusH : Enthalpy of fusion at a given temperature (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- ΔvapH : Enthalpy of vaporization at a given temperature (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 | 0.5699 | Relay (... Calculated Property | |
| ΔfG° | -165.84 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -469.95 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 20.81 | kJ/mol | Thermod... |
| ΔvapH° | 79.98 | kJ/mol | Relay (... Calculated Property |
| IE | 8.99 | eV | Relay (... Calculated Property |
| log10WS | -1.64 | Relay (... Calculated Property | |
| logPoct/wat | 2.441 | Crippen Calculated Property | |
| McVol | 165.660 | ml/mol | McGowan Calculated Property |
| Pc | 3127.99 | kPa | Joback Calculated Property |
| Tboil | 562.84 | K | Relay (... Calculated Property |
| Tc | 820.32 | K | Relay (... Calculated Property |
| Tfus | 377.30 | K | Relay (... Calculated Property |
| Vc | 0.571 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [495.44; 599.27] | J/mol×K | [673.30; 907.47] | 
|
| Cp,gas | 495.44 | J/mol×K | 673.30 | Joback Calculated Property |
| Cp,gas | 515.16 | J/mol×K | 712.33 | Joback Calculated Property |
| Cp,gas | 533.75 | J/mol×K | 751.36 | Joback Calculated Property |
| Cp,gas | 551.34 | J/mol×K | 790.39 | Joback Calculated Property |
| Cp,gas | 568.03 | J/mol×K | 829.42 | Joback Calculated Property |
| Cp,gas | 583.97 | J/mol×K | 868.45 | Joback Calculated Property |
| Cp,gas | 599.27 | J/mol×K | 907.47 | Joback Calculated Property |
| ΔfusH | 20.81 | kJ/mol | 157.50 | NIST |
| ΔvapH | 87.74 | kJ/mol | 303.11 | Thermod... |
Similar Compounds
Find more compounds similar to [1,1'-Bicyclohexyl]-2-one, 1'-hydroxy-.
Mixtures
Sources
- Cheméo Relay (1.0)
- Crippen Method
- Crippen Method
- Thermodynamic Properties for 2-(1'-Hydroxycyclohexyl)cyclohexanone and Equilibrium of Dimerization of Cyclohexanone
- Thermodynamics of 2-(1'-Hydroxycyclohexyl)cyclohexanone: Vaporization, Sublimation, and the Ideal Gas State Thermodynamic Properties
- Joback Method
- McGowan Method
- NIST Webbook
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