- InChI
- InChI=1S/C13H5Cl5O3/c14-7-8(15)10(17)12(11(18)9(7)16)21-13(20)5-3-1-2-4-6(5)19/h1-4,19H
- InChI Key
- ZMZPNTFEPFRJHW-UHFFFAOYSA-N
- Formula
- C13H5Cl5O3
- SMILES
-
O=C(Oc1c(Cl)c(Cl)c(Cl)c(Cl)c1C
l)c1ccccc1O - Molecular Weight1
- 386.44
- CAS
- 36994-69-1
- 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° | -212.94 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -396.75 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 45.12 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 96.49 | kJ/mol | Joback Calculated Property |
| log10WS | -6.53 | Crippen Calculated Property | |
| logPoct/wat | 5.878 | Crippen Calculated Property | |
| McVol | 221.020 | ml/mol | McGowan Calculated Property |
| Pc | 2862.74 | kPa | Joback Calculated Property |
| Tboil | 919.16 | K | Joback Calculated Property |
| Tc | 1185.72 | K | Joback Calculated Property |
| Tfus | 685.19 | K | Joback Calculated Property |
| Vc | 0.782 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [495.84; 536.06] | J/mol×K | [919.16; 1185.72] | 
|
| Cp,gas | 495.84 | J/mol×K | 919.16 | Joback Calculated Property |
| Cp,gas | 503.28 | J/mol×K | 963.59 | Joback Calculated Property |
| Cp,gas | 510.29 | J/mol×K | 1008.01 | Joback Calculated Property |
| Cp,gas | 516.98 | J/mol×K | 1052.44 | Joback Calculated Property |
| Cp,gas | 523.44 | J/mol×K | 1096.87 | Joback Calculated Property |
| Cp,gas | 529.77 | J/mol×K | 1141.29 | Joback Calculated Property |
| Cp,gas | 536.06 | J/mol×K | 1185.72 | Joback Calculated Property |
| η | [0.0000043; 0.0000287] | Pa×s | [685.19; 919.16] |
|
| η | 0.0000287 | Pa×s | 685.19 | Joback Calculated Property |
| η | 0.0000192 | Pa×s | 724.19 | Joback Calculated Property |
| η | 0.0000134 | Pa×s | 763.18 | Joback Calculated Property |
| η | 0.0000097 | Pa×s | 802.17 | Joback Calculated Property |
| η | 0.0000072 | Pa×s | 841.17 | Joback Calculated Property |
| η | 0.0000055 | Pa×s | 880.16 | Joback Calculated Property |
| η | 0.0000043 | Pa×s | 919.16 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Pentachlorophenyl salicylate.
Sources
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