- InChI
- InChI=1S/C18H23Cl5O2/c1-2-3-4-5-6-7-8-9-10-11-12(24)25-18-16(22)14(20)13(19)15(21)17(18)23/h2-11H2,1H3
- InChI Key
- MKNJWAXSYGAMGJ-UHFFFAOYSA-N
- Formula
- C18H23Cl5O2
- SMILES
-
CCCCCCCCCCCC(=O)Oc1c(Cl)c(Cl)c
(Cl)c(Cl)c1Cl - Molecular Weight1
- 448.64
- CAS
- 3772-94-9
- Other Names
-
- pentachlorophenyl laurate
- 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° | -128.63 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -559.17 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 58.24 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 92.33 | kJ/mol | Joback Calculated Property |
| log10WS | -9.40 | Crippen Calculated Property | |
| logPoct/wat | 8.780 | Crippen Calculated Property | |
| McVol | 309.360 | ml/mol | McGowan Calculated Property |
| Pc | 1249.49 | kPa | Joback Calculated Property |
| Tboil | 926.26 | K | Joback Calculated Property |
| Tc | 1144.44 | K | Joback Calculated Property |
| Tfus | 603.40 | K | Joback Calculated Property |
| Vc | 1.204 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [839.81; 897.33] | J/mol×K | [926.26; 1144.44] | 
|
| Cp,gas | 839.81 | J/mol×K | 926.26 | Joback Calculated Property |
| Cp,gas | 851.82 | J/mol×K | 962.62 | Joback Calculated Property |
| Cp,gas | 862.82 | J/mol×K | 998.99 | Joback Calculated Property |
| Cp,gas | 872.84 | J/mol×K | 1035.35 | Joback Calculated Property |
| Cp,gas | 881.92 | J/mol×K | 1071.71 | Joback Calculated Property |
| Cp,gas | 890.07 | J/mol×K | 1108.07 | Joback Calculated Property |
| Cp,gas | 897.33 | J/mol×K | 1144.44 | Joback Calculated Property |
| η | [0.0000506; 0.0002873] | Pa×s | [603.40; 926.26] |
|
| η | 0.0002873 | Pa×s | 603.40 | Joback Calculated Property |
| η | 0.0001911 | Pa×s | 657.21 | Joback Calculated Property |
| η | 0.0001351 | Pa×s | 711.02 | Joback Calculated Property |
| η | 0.0001004 | Pa×s | 764.83 | Joback Calculated Property |
| η | 0.0000775 | Pa×s | 818.64 | Joback Calculated Property |
| η | 0.0000618 | Pa×s | 872.45 | Joback Calculated Property |
| η | 0.0000506 | Pa×s | 926.26 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Lauric acid, pentachlorophenyl ester.
Sources
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