- InChI
- InChI=1S/C10H12ClFO/c1-7(2)13-6-8-9(11)4-3-5-10(8)12/h3-5,7H,6H2,1-2H3
- InChI Key
- LCAGIUAMUFTSHZ-UHFFFAOYSA-N
- Formula
- C10H12ClFO
- SMILES
- CC(C)OCc1c(F)cccc1Cl
- Molecular Weight1
- 202.65
- 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).
- 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).
- Inp : Non-polar retention indices.
- 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 | 0.4432 | Relay (1.0) Calculated Property | |
| ΔfG° | -187.71 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -366.16 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 19.86 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 59.02 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.80 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.72 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.404 | Crippen Calculated Property | |
| McVol | 147.880 | ml/mol | McGowan Calculated Property |
| Pc | 2581.96 | kPa | Joback Calculated Property |
| Inp | 1264.00 | NIST | |
| Tboil | 486.23 | K | Relay (1.0) Calculated Property |
| Tc | 697.11 | K | Relay (1.0) Calculated Property |
| Tfus | 281.81 | K | Relay (1.0) Calculated Property |
| Vc | 0.539 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [318.00; 386.51] | J/mol×K | [523.52; 728.35] | 
|
| Cp,gas | 318.00 | J/mol×K | 523.52 | Joback Calculated Property |
| Cp,gas | 330.99 | J/mol×K | 557.66 | Joback Calculated Property |
| Cp,gas | 343.33 | J/mol×K | 591.80 | Joback Calculated Property |
| Cp,gas | 355.05 | J/mol×K | 625.94 | Joback Calculated Property |
| Cp,gas | 366.14 | J/mol×K | 660.07 | Joback Calculated Property |
| Cp,gas | 376.62 | J/mol×K | 694.21 | Joback Calculated Property |
| Cp,gas | 386.51 | J/mol×K | 728.35 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Chloro-6-fluorobenzyl alcohol, isopropyl ether.
Sources
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