- InChI
- InChI=1S/C12H13ClO/c1-3-5-9-7-11(13)8-10(6-4-2)12(9)14/h3-4,7-8,14H,1-2,5-6H2
- InChI Key
- RANSQHWYECVCMB-UHFFFAOYSA-N
- Formula
- C12H13ClO
- SMILES
- C=CCc1cc(Cl)cc(CC=C)c1O
- Molecular Weight1
- 208.68
- CAS
- 73267-76-2
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | 152.44 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -19.61 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 27.52 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 61.97 | kJ/mol | Joback Calculated Property |
| log10WS | -3.85 | Crippen Calculated Property | |
| logPoct/wat | 3.503 | Crippen Calculated Property | |
| McVol | 165.690 | ml/mol | McGowan Calculated Property |
| Pc | 2850.52 | kPa | Joback Calculated Property |
| Tboil | 622.01 | K | Joback Calculated Property |
| Tc | 847.72 | K | Joback Calculated Property |
| Tfus | 414.58 | K | Joback Calculated Property |
| Vc | 0.577 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [388.58; 452.68] | J/mol×K | [622.01; 847.72] | 
|
| Cp,gas | 388.58 | J/mol×K | 622.01 | Joback Calculated Property |
| Cp,gas | 400.98 | J/mol×K | 659.63 | Joback Calculated Property |
| Cp,gas | 412.58 | J/mol×K | 697.25 | Joback Calculated Property |
| Cp,gas | 423.46 | J/mol×K | 734.86 | Joback Calculated Property |
| Cp,gas | 433.71 | J/mol×K | 772.48 | Joback Calculated Property |
| Cp,gas | 443.42 | J/mol×K | 810.10 | Joback Calculated Property |
| Cp,gas | 452.68 | J/mol×K | 847.72 | Joback Calculated Property |
| η | [0.0000306; 0.0007190] | Pa×s | [414.58; 622.01] |
|
| η | 0.0007190 | Pa×s | 414.58 | Joback Calculated Property |
| η | 0.0003469 | Pa×s | 449.15 | Joback Calculated Property |
| η | 0.0001858 | Pa×s | 483.72 | Joback Calculated Property |
| η | 0.0001081 | Pa×s | 518.30 | Joback Calculated Property |
| η | 0.0000673 | Pa×s | 552.87 | Joback Calculated Property |
| η | 0.0000443 | Pa×s | 587.44 | Joback Calculated Property |
| η | 0.0000306 | Pa×s | 622.01 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2,6-Diallyl-4-chlorophenol.
Sources
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