- InChI
- InChI=1S/C4H6Cl3I/c5-1-3(7)4(8)2-6/h3-4H,1-2H2
- InChI Key
- KCMZWZSUXFIJLT-UHFFFAOYSA-N
- Formula
- C4H6Cl3I
- SMILES
- ClCC(Cl)C(I)CCl
- Molecular Weight1
- 287.35
- CAS
- 116401-08-2
- 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° | 0.25 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -106.80 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 16.07 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 46.25 | kJ/mol | Joback Calculated Property |
| log10WS | -3.13 | Crippen Calculated Property | |
| logPoct/wat | 2.875 | Crippen Calculated Property | |
| McVol | 129.760 | ml/mol | McGowan Calculated Property |
| Pc | 3384.14 | kPa | Joback Calculated Property |
| Tboil | 495.47 | K | Joback Calculated Property |
| Tc | 731.61 | K | Joback Calculated Property |
| Tfus | 252.66 | K | Joback Calculated Property |
| Vc | 0.482 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [199.98; 235.71] | J/mol×K | [495.47; 731.61] | 
|
| Cp,gas | 199.98 | J/mol×K | 495.47 | Joback Calculated Property |
| Cp,gas | 207.19 | J/mol×K | 534.83 | Joback Calculated Property |
| Cp,gas | 213.85 | J/mol×K | 574.18 | Joback Calculated Property |
| Cp,gas | 220.00 | J/mol×K | 613.54 | Joback Calculated Property |
| Cp,gas | 225.66 | J/mol×K | 652.90 | Joback Calculated Property |
| Cp,gas | 230.89 | J/mol×K | 692.26 | Joback Calculated Property |
| Cp,gas | 235.71 | J/mol×K | 731.61 | Joback Calculated Property |
| η | [0.0003572; 0.0084667] | Pa×s | [252.66; 495.47] |
|
| η | 0.0084667 | Pa×s | 252.66 | Joback Calculated Property |
| η | 0.0034707 | Pa×s | 293.13 | Joback Calculated Property |
| η | 0.0017663 | Pa×s | 333.60 | Joback Calculated Property |
| η | 0.0010404 | Pa×s | 374.07 | Joback Calculated Property |
| η | 0.0006795 | Pa×s | 414.53 | Joback Calculated Property |
| η | 0.0004788 | Pa×s | 455.00 | Joback Calculated Property |
| η | 0.0003572 | Pa×s | 495.47 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,2,4-Trichloro-3-iodobutane.
Sources
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