- InChI
- InChI=1S/C12H17ClO/c1-7(2)9-5-10(8(3)4)12(14)11(13)6-9/h5-8,14H,1-4H3
- InChI Key
- SVBPZUZWTSMLKY-UHFFFAOYSA-N
- Formula
- C12H17ClO
- SMILES
- CC(C)c1cc(Cl)c(O)c(C(C)C)c1
- Molecular Weight1
- 212.72
- CAS
- 102127-39-9
- 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° | -28.12 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -281.03 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 23.03 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 62.53 | kJ/mol | Joback Calculated Property |
| log10WS | -4.07 | Crippen Calculated Property | |
| logPoct/wat | 4.292 | Crippen Calculated Property | |
| McVol | 174.290 | ml/mol | McGowan Calculated Property |
| Pc | 2654.29 | kPa | Joback Calculated Property |
| Tboil | 627.77 | K | Joback Calculated Property |
| Tc | 853.57 | K | Joback Calculated Property |
| Tfus | 388.10 | K | Joback Calculated Property |
| Vc | 0.603 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [432.39; 507.43] | J/mol×K | [627.77; 853.57] | 
|
| Cp,gas | 432.39 | J/mol×K | 627.77 | Joback Calculated Property |
| Cp,gas | 446.85 | J/mol×K | 665.40 | Joback Calculated Property |
| Cp,gas | 460.42 | J/mol×K | 703.04 | Joback Calculated Property |
| Cp,gas | 473.19 | J/mol×K | 740.67 | Joback Calculated Property |
| Cp,gas | 485.23 | J/mol×K | 778.30 | Joback Calculated Property |
| Cp,gas | 496.61 | J/mol×K | 815.93 | Joback Calculated Property |
| Cp,gas | 507.43 | J/mol×K | 853.57 | Joback Calculated Property |
| η | [0.0000238; 0.0013825] | Pa×s | [388.10; 627.77] |
|
| η | 0.0013825 | Pa×s | 388.10 | Joback Calculated Property |
| η | 0.0005120 | Pa×s | 428.05 | Joback Calculated Property |
| η | 0.0002247 | Pa×s | 467.99 | Joback Calculated Property |
| η | 0.0001122 | Pa×s | 507.94 | Joback Calculated Property |
| η | 0.0000620 | Pa×s | 547.88 | Joback Calculated Property |
| η | 0.0000372 | Pa×s | 587.83 | Joback Calculated Property |
| η | 0.0000238 | Pa×s | 627.77 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 6-Chloro-2,4-diisopropyl phenol.
Sources
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