- InChI
- InChI=1S/C15H15Cl5O4/c1-7(2)6-23-8(21)4-3-5-9(22)24-15-13(19)11(17)10(16)12(18)14(15)20/h7H,3-6H2,1-2H3
- InChI Key
- RRRKJOCBHJXELM-UHFFFAOYSA-N
- Formula
- C15H15Cl5O4
- SMILES
-
CC(C)COC(=O)CCCC(=O)Oc1c(Cl)c(
Cl)c(Cl)c(Cl)c1Cl - Molecular Weight1
- 436.54
- 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° | -390.25 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -747.33 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 49.74 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 94.42 | kJ/mol | Joback Calculated Property |
| log10WS | -6.76 | Crippen Calculated Property | |
| logPoct/wat | 6.228 | Crippen Calculated Property | |
| McVol | 274.530 | ml/mol | McGowan Calculated Property |
| Pc | 1616.77 | kPa | Joback Calculated Property |
| Inp | [2745.00; 2745.00] |
|
|
| Inp | 2745.00 | NIST | |
| Inp | 2745.00 | NIST | |
| Tboil | 933.47 | K | Joback Calculated Property |
| Tc | 1161.44 | K | Joback Calculated Property |
| Tfus | 626.75 | K | Joback Calculated Property |
| Vc | 1.054 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [701.60; 738.31] | J/mol×K | [933.47; 1161.44] |
|
| Cp,gas | 701.60 | J/mol×K | 933.47 | Joback Calculated Property |
| Cp,gas | 710.46 | J/mol×K | 971.46 | Joback Calculated Property |
| Cp,gas | 718.23 | J/mol×K | 1009.46 | Joback Calculated Property |
| Cp,gas | 724.90 | J/mol×K | 1047.45 | Joback Calculated Property |
| Cp,gas | 730.48 | J/mol×K | 1085.45 | Joback Calculated Property |
| Cp,gas | 734.95 | J/mol×K | 1123.44 | Joback Calculated Property |
| Cp,gas | 738.31 | J/mol×K | 1161.44 | Joback Calculated Property |
| η | [0.0000509; 0.0002627] | Pa×s | [626.75; 933.47] |
|
| η | 0.0002627 | Pa×s | 626.75 | Joback Calculated Property |
| η | 0.0001802 | Pa×s | 677.87 | Joback Calculated Property |
| η | 0.0001304 | Pa×s | 728.99 | Joback Calculated Property |
| η | 0.0000984 | Pa×s | 780.11 | Joback Calculated Property |
| η | 0.0000769 | Pa×s | 831.23 | Joback Calculated Property |
| η | 0.0000618 | Pa×s | 882.35 | Joback Calculated Property |
| η | 0.0000509 | Pa×s | 933.47 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, isobutyl pentachlorophenyl ester.
Sources
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