- InChI
- InChI=1S/C11H11Cl3O3/c1-2-3-16-11(15)6-17-10-5-8(13)7(12)4-9(10)14/h4-5H,2-3,6H2,1H3
- InChI Key
- KQPZLIOOEZZUFO-UHFFFAOYSA-N
- Formula
- C11H11Cl3O3
- SMILES
- CCCOC(=O)COc1cc(Cl)c(Cl)cc1Cl
- Molecular Weight1
- 297.56
- CAS
- 1928-40-1
- Other Names
-
- 2,4,5-T, propyl ester
- propyl 2,4,5-trichlorophenoxyacetate
- 2,4,5-Trichlorophenoxyacetic acid, propyl ester
- 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).
- ΔvapH : Enthalpy of vaporization at a given temperature (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° | -249.45 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -492.49 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 33.69 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 69.06 | kJ/mol | Joback Calculated Property |
| log10WS | -4.18 | Crippen Calculated Property | |
| logPoct/wat | 3.979 | Crippen Calculated Property | |
| McVol | 192.120 | ml/mol | McGowan Calculated Property |
| Pc | 2333.78 | kPa | Joback Calculated Property |
| Tboil | 703.70 | K | Joback Calculated Property |
| Tc | 924.00 | K | Joback Calculated Property |
| Tfus | 461.86 | K | Joback Calculated Property |
| Vc | 0.733 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [442.67; 497.44] | J/mol×K | [703.70; 924.00] | 
|
| Cp,gas | 442.67 | J/mol×K | 703.70 | Joback Calculated Property |
| Cp,gas | 453.65 | J/mol×K | 740.42 | Joback Calculated Property |
| Cp,gas | 463.90 | J/mol×K | 777.13 | Joback Calculated Property |
| Cp,gas | 473.41 | J/mol×K | 813.85 | Joback Calculated Property |
| Cp,gas | 482.17 | J/mol×K | 850.57 | Joback Calculated Property |
| Cp,gas | 490.19 | J/mol×K | 887.28 | Joback Calculated Property |
| Cp,gas | 497.44 | J/mol×K | 924.00 | Joback Calculated Property |
| η | [0.0001268; 0.0006663] | Pa×s | [461.86; 703.70] |
|
| η | 0.0006663 | Pa×s | 461.86 | Joback Calculated Property |
| η | 0.0004523 | Pa×s | 502.17 | Joback Calculated Property |
| η | 0.0003251 | Pa×s | 542.47 | Joback Calculated Property |
| η | 0.0002447 | Pa×s | 582.78 | Joback Calculated Property |
| η | 0.0001910 | Pa×s | 623.09 | Joback Calculated Property |
| η | 0.0001537 | Pa×s | 663.39 | Joback Calculated Property |
| η | 0.0001268 | Pa×s | 703.70 | Joback Calculated Property |
| ΔvapH | 83.20 | kJ/mol | 508.50 | NIST |
Similar Compounds
Find more compounds similar to N-propyl ester of 2,4,5-trichlorophenoxy acetic acid.
Sources
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