- InChI
- InChI=1S/C9H10Cl2O/c1-2-3-6-7(10)4-5-8(11)9(6)12/h4-5,12H,2-3H2,1H3
- InChI Key
- ITRKBGGUVDEKOC-UHFFFAOYSA-N
- Formula
- C9H10Cl2O
- SMILES
- CCCc1c(Cl)ccc(Cl)c1O
- Molecular Weight1
- 205.08
- CAS
- 116632-96-3
- 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° | -60.43 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -224.29 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 26.51 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 61.01 | kJ/mol | Joback Calculated Property |
| log10WS | -3.61 | Crippen Calculated Property | |
| logPoct/wat | 3.651 | Crippen Calculated Property | |
| McVol | 144.260 | ml/mol | McGowan Calculated Property |
| Pc | 3435.91 | kPa | Joback Calculated Property |
| Tboil | 597.44 | K | Joback Calculated Property |
| Tc | 830.40 | K | Joback Calculated Property |
| Tfus | 414.21 | K | Joback Calculated Property |
| Vc | 0.495 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [313.50; 367.12] | J/mol×K | [597.44; 830.40] | 
|
| Cp,gas | 313.50 | J/mol×K | 597.44 | Joback Calculated Property |
| Cp,gas | 323.94 | J/mol×K | 636.27 | Joback Calculated Property |
| Cp,gas | 333.68 | J/mol×K | 675.09 | Joback Calculated Property |
| Cp,gas | 342.79 | J/mol×K | 713.92 | Joback Calculated Property |
| Cp,gas | 351.35 | J/mol×K | 752.75 | Joback Calculated Property |
| Cp,gas | 359.43 | J/mol×K | 791.57 | Joback Calculated Property |
| Cp,gas | 367.12 | J/mol×K | 830.40 | Joback Calculated Property |
| η | [0.0000414; 0.0007683] | Pa×s | [414.21; 597.44] |
|
| η | 0.0007683 | Pa×s | 414.21 | Joback Calculated Property |
| η | 0.0003995 | Pa×s | 444.75 | Joback Calculated Property |
| η | 0.0002260 | Pa×s | 475.29 | Joback Calculated Property |
| η | 0.0001369 | Pa×s | 505.83 | Joback Calculated Property |
| η | 0.0000878 | Pa×s | 536.36 | Joback Calculated Property |
| η | 0.0000591 | Pa×s | 566.90 | Joback Calculated Property |
| η | 0.0000414 | Pa×s | 597.44 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3,6-Dichloro-2-propyl phenol.
Sources
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