- InChI
- InChI=1S/C11H13I3O/c1-2-3-4-15-7-8-5-9(12)6-10(13)11(8)14/h5-6H,2-4,7H2,1H3
- InChI Key
- YZCUYJDABIDFNK-UHFFFAOYSA-N
- Formula
- C11H13I3O
- SMILES
- CCCCOCc1cc(I)cc(I)c1I
- Molecular Weight1
- 541.93
- 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° | 194.62 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 30.14 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 31.53 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 74.87 | kJ/mol | Joback Calculated Property |
| log10WS | -6.56 | Crippen Calculated Property | |
| logPoct/wat | 4.817 | Crippen Calculated Property | |
| McVol | 225.420 | ml/mol | McGowan Calculated Property |
| Pc | 2331.52 | kPa | Joback Calculated Property |
| Inp | [2508.00; 2508.00] |
|
|
| Inp | 2508.00 | NIST | |
| Inp | 2508.00 | NIST | |
| Tboil | 794.54 | K | Joback Calculated Property |
| Tc | 1077.66 | K | Joback Calculated Property |
| Tfus | 474.12 | K | Joback Calculated Property |
| Vc | 0.826 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [462.37; 518.11] | J/mol×K | [794.54; 1077.66] |
|
| Cp,gas | 462.37 | J/mol×K | 794.54 | Joback Calculated Property |
| Cp,gas | 473.56 | J/mol×K | 841.73 | Joback Calculated Property |
| Cp,gas | 483.87 | J/mol×K | 888.91 | Joback Calculated Property |
| Cp,gas | 493.40 | J/mol×K | 936.10 | Joback Calculated Property |
| Cp,gas | 502.22 | J/mol×K | 983.29 | Joback Calculated Property |
| Cp,gas | 510.43 | J/mol×K | 1030.47 | Joback Calculated Property |
| Cp,gas | 518.11 | J/mol×K | 1077.66 | Joback Calculated Property |
| η | [0.0001013; 0.0007897] | Pa×s | [474.12; 794.54] |
|
| η | 0.0007897 | Pa×s | 474.12 | Joback Calculated Property |
| η | 0.0004716 | Pa×s | 527.52 | Joback Calculated Property |
| η | 0.0003096 | Pa×s | 580.93 | Joback Calculated Property |
| η | 0.0002182 | Pa×s | 634.33 | Joback Calculated Property |
| η | 0.0001624 | Pa×s | 687.73 | Joback Calculated Property |
| η | 0.0001261 | Pa×s | 741.14 | Joback Calculated Property |
| η | 0.0001013 | Pa×s | 794.54 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2,3,5-Triiodobenzyl alcohol, n-butyl ether.
Sources
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