- InChI
- InChI=1S/C12H15ClO/c13-11-8-4-7-10(12(11)14)9-5-2-1-3-6-9/h4,7-9,14H,1-3,5-6H2
- InChI Key
- RVZSBLFOFVODMM-UHFFFAOYSA-N
- Formula
- C12H15ClO
- SMILES
- Oc1c(Cl)cccc1C1CCCCC1
- Molecular Weight1
- 210.70
- CAS
- 57883-04-2
- 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 | 0.5273 | Relay (1.0) Calculated Property | |
| ΔfG° | 10.84 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -197.46 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 22.30 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 79.63 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.26 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.90 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.093 | Crippen Calculated Property | |
| McVol | 163.430 | ml/mol | McGowan Calculated Property |
| Pc | 3314.37 | kPa | Joback Calculated Property |
| Tboil | 550.31 | K | Relay (1.0) Calculated Property |
| Tc | 832.71 | K | Relay (1.0) Calculated Property |
| Tfus | 336.87 | K | Relay (1.0) Calculated Property |
| Vc | 0.558 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [421.91; 507.20] | J/mol×K | [643.22; 898.99] | 
|
| Cp,gas | 421.91 | J/mol×K | 643.22 | Joback Calculated Property |
| Cp,gas | 439.02 | J/mol×K | 685.85 | Joback Calculated Property |
| Cp,gas | 454.79 | J/mol×K | 728.48 | Joback Calculated Property |
| Cp,gas | 469.37 | J/mol×K | 771.11 | Joback Calculated Property |
| Cp,gas | 482.87 | J/mol×K | 813.73 | Joback Calculated Property |
| Cp,gas | 495.44 | J/mol×K | 856.36 | Joback Calculated Property |
| Cp,gas | 507.20 | J/mol×K | 898.99 | Joback Calculated Property |
| η | [0.0000272; 0.0010666] | Pa×s | [412.96; 643.22] |
|
| η | 0.0010666 | Pa×s | 412.96 | Joback Calculated Property |
| η | 0.0004463 | Pa×s | 451.34 | Joback Calculated Property |
| η | 0.0002141 | Pa×s | 489.71 | Joback Calculated Property |
| η | 0.0001143 | Pa×s | 528.09 | Joback Calculated Property |
| η | 0.0000664 | Pa×s | 566.47 | Joback Calculated Property |
| η | 0.0000413 | Pa×s | 604.84 | Joback Calculated Property |
| η | 0.0000272 | Pa×s | 643.22 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Chloro-6-cyclohexyl phenol.
Sources
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