- InChI
- InChI=1S/C12H17IO/c1-3-10(2)8-14-9-11-5-4-6-12(13)7-11/h4-7,10H,3,8-9H2,1-2H3
- InChI Key
- ISXGSDJHEUJBAN-UHFFFAOYSA-N
- Formula
- C12H17IO
- SMILES
- CCC(C)COCc1cccc(I)c1
- Molecular Weight1
- 304.17
- 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).
- 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° | 103.62 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -126.58 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 22.56 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 56.64 | kJ/mol | Joback Calculated Property |
| log10WS | -4.44 | Crippen Calculated Property | |
| logPoct/wat | 3.854 | Crippen Calculated Property | |
| McVol | 187.870 | ml/mol | McGowan Calculated Property |
| Pc | 2300.32 | kPa | Joback Calculated Property |
| Inp | 1713.00 | NIST | |
| Tboil | 620.74 | K | Joback Calculated Property |
| Tc | 851.41 | K | Joback Calculated Property |
| Tfus | 329.23 | K | Joback Calculated Property |
| Vc | 0.700 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [430.19; 509.59] | J/mol×K | [620.74; 851.41] | 
|
| Cp,gas | 430.19 | J/mol×K | 620.74 | Joback Calculated Property |
| Cp,gas | 445.77 | J/mol×K | 659.19 | Joback Calculated Property |
| Cp,gas | 460.36 | J/mol×K | 697.63 | Joback Calculated Property |
| Cp,gas | 474.00 | J/mol×K | 736.08 | Joback Calculated Property |
| Cp,gas | 486.72 | J/mol×K | 774.52 | Joback Calculated Property |
| Cp,gas | 498.57 | J/mol×K | 812.97 | Joback Calculated Property |
| Cp,gas | 509.59 | J/mol×K | 851.41 | Joback Calculated Property |
| η | [0.0001500; 0.0023806] | Pa×s | [329.23; 620.74] |
|
| η | 0.0023806 | Pa×s | 329.23 | Joback Calculated Property |
| η | 0.0011168 | Pa×s | 377.81 | Joback Calculated Property |
| η | 0.0006225 | Pa×s | 426.40 | Joback Calculated Property |
| η | 0.0003911 | Pa×s | 474.99 | Joback Calculated Property |
| η | 0.0002678 | Pa×s | 523.57 | Joback Calculated Property |
| η | 0.0001956 | Pa×s | 572.15 | Joback Calculated Property |
| η | 0.0001500 | Pa×s | 620.74 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to (3-Iodophenyl) methanol, 2-methylbutyl ether.
Sources
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