- InChI
- InChI=1S/C21H24Cl2O4/c1-4-18(13(2)3)26-19(24)10-7-11-20(25)27-21-15-9-6-5-8-14(15)16(22)12-17(21)23/h5-6,8-9,12-13,18H,4,7,10-11H2,1-3H3
- InChI Key
- QAGQVDVHJQCORU-UHFFFAOYSA-N
- Formula
- C21H24Cl2O4
- SMILES
-
CCC(OC(=O)CCCC(=O)Oc1c(Cl)cc(C
l)c2ccccc12)C(C)C - Molecular Weight1
- 411.32
- 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° | -180.47 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -615.22 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 46.96 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 94.55 | kJ/mol | Joback Calculated Property |
| log10WS | -7.46 | Crippen Calculated Property | |
| logPoct/wat | 6.200 | Crippen Calculated Property | |
| McVol | 302.890 | ml/mol | McGowan Calculated Property |
| Pc | 1403.79 | kPa | Joback Calculated Property |
| Inp | [2942.00; 2942.00] |
|
|
| Inp | 2942.00 | NIST | |
| Inp | 2942.00 | NIST | |
| Tboil | 967.04 | K | Joback Calculated Property |
| Tc | 1195.44 | K | Joback Calculated Property |
| Tfus | 597.27 | K | Joback Calculated Property |
| Vc | 1.159 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [906.18; 964.52] | J/mol×K | [967.04; 1195.44] |
|
| Cp,gas | 906.18 | J/mol×K | 967.04 | Joback Calculated Property |
| Cp,gas | 918.56 | J/mol×K | 1005.11 | Joback Calculated Property |
| Cp,gas | 929.81 | J/mol×K | 1043.17 | Joback Calculated Property |
| Cp,gas | 939.97 | J/mol×K | 1081.24 | Joback Calculated Property |
| Cp,gas | 949.11 | J/mol×K | 1119.31 | Joback Calculated Property |
| Cp,gas | 957.28 | J/mol×K | 1157.38 | Joback Calculated Property |
| Cp,gas | 964.52 | J/mol×K | 1195.44 | Joback Calculated Property |
| η | [0.0000623; 0.0004319] | Pa×s | [597.27; 967.04] |
|
| η | 0.0004319 | Pa×s | 597.27 | Joback Calculated Property |
| η | 0.0002689 | Pa×s | 658.90 | Joback Calculated Property |
| η | 0.0001816 | Pa×s | 720.53 | Joback Calculated Property |
| η | 0.0001305 | Pa×s | 782.15 | Joback Calculated Property |
| η | 0.0000984 | Pa×s | 843.78 | Joback Calculated Property |
| η | 0.0000771 | Pa×s | 905.41 | Joback Calculated Property |
| η | 0.0000623 | Pa×s | 967.04 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, 2-methylpent-3-yl 2,4-dichloro-1-naphthyl ester.
Sources
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