- InChI
- InChI=1S/C17H11Cl2NO4/c18-13-2-1-3-14(17(13)19)24-16(22)9-8-15(21)23-12-6-4-11(10-20)5-7-12/h1-7H,8-9H2
- InChI Key
- PKDWSBSDCSHHAB-UHFFFAOYSA-N
- Formula
- C17H11Cl2NO4
- SMILES
-
N#Cc1ccc(OC(=O)CCC(=O)Oc2cccc(
Cl)c2Cl)cc1 - Molecular Weight1
- 364.18
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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° | -70.33 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -311.76 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 42.17 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 97.53 | kJ/mol | Joback Calculated Property |
| log10WS | -5.47 | Crippen Calculated Property | |
| logPoct/wat | 4.156 | Crippen Calculated Property | |
| McVol | 243.610 | ml/mol | McGowan Calculated Property |
| Pc | 1992.98 | kPa | Joback Calculated Property |
| Inp | 2962.00 | NIST | |
| Tboil | 986.18 | K | Joback Calculated Property |
| Tc | 1235.17 | K | Joback Calculated Property |
| Tfus | 640.90 | K | Joback Calculated Property |
| Vc | 0.944 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [655.74; 680.83] | J/mol×K | [986.18; 1235.17] | 
|
| Cp,gas | 655.74 | J/mol×K | 986.18 | Joback Calculated Property |
| Cp,gas | 662.90 | J/mol×K | 1027.68 | Joback Calculated Property |
| Cp,gas | 668.84 | J/mol×K | 1069.18 | Joback Calculated Property |
| Cp,gas | 673.57 | J/mol×K | 1110.67 | Joback Calculated Property |
| Cp,gas | 677.14 | J/mol×K | 1152.17 | Joback Calculated Property |
| Cp,gas | 679.55 | J/mol×K | 1193.67 | Joback Calculated Property |
| Cp,gas | 680.83 | J/mol×K | 1235.17 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, 4-cyanophenyl 2,3-dichlorophenyl ester.
Sources
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