- InChI
- InChI=1S/C12H17FO/c1-12(2,3)9-14-8-10-4-6-11(13)7-5-10/h4-7H,8-9H2,1-3H3
- InChI Key
- IODTUJJPFDTQAM-UHFFFAOYSA-N
- Formula
- C12H17FO
- SMILES
- CC(C)(C)COCc1ccc(F)cc1
- Molecular Weight1
- 196.26
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | -144.03 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -403.03 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 17.34 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 45.54 | kJ/mol | Joback Calculated Property |
| log10WS | -3.62 | Crippen Calculated Property | |
| logPoct/wat | 3.388 | Crippen Calculated Property | |
| McVol | 163.820 | ml/mol | McGowan Calculated Property |
| Pc | 2274.07 | kPa | Joback Calculated Property |
| Inp | 1240.00 | NIST | |
| Tboil | 524.08 | K | Joback Calculated Property |
| Tc | 724.94 | K | Joback Calculated Property |
| Tfus | 289.18 | K | Joback Calculated Property |
| Vc | 0.625 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [383.60; 469.04] | J/mol×K | [524.08; 724.94] | 
|
| Cp,gas | 383.60 | J/mol×K | 524.08 | Joback Calculated Property |
| Cp,gas | 400.03 | J/mol×K | 557.56 | Joback Calculated Property |
| Cp,gas | 415.54 | J/mol×K | 591.03 | Joback Calculated Property |
| Cp,gas | 430.16 | J/mol×K | 624.51 | Joback Calculated Property |
| Cp,gas | 443.92 | J/mol×K | 657.99 | Joback Calculated Property |
| Cp,gas | 456.87 | J/mol×K | 691.47 | Joback Calculated Property |
| Cp,gas | 469.04 | J/mol×K | 724.94 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to (4-Fluorophenyl) methanol, neopentyl ether.
Sources
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