- InChI
- InChI=1S/C17H21ClO5/c1-4-14(11(2)3)22-16(20)7-8-17(21)23-15-6-5-13(18)9-12(15)10-19/h5-6,9-11,14H,4,7-8H2,1-3H3
- InChI Key
- VMDZVBBEWVWINT-UHFFFAOYSA-N
- Formula
- C17H21ClO5
- SMILES
-
CCC(OC(=O)CCC(=O)Oc1ccc(Cl)cc1
C=O)C(C)C - Molecular Weight1
- 340.80
- 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° | -398.76 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -782.10 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 38.06 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 85.68 | kJ/mol | Joback Calculated Property |
| log10WS | -4.79 | Crippen Calculated Property | |
| logPoct/wat | 3.816 | Crippen Calculated Property | |
| McVol | 255.320 | ml/mol | McGowan Calculated Property |
| Pc | 1730.34 | kPa | Joback Calculated Property |
| Inp | [2396.00; 2396.00] |
|
|
| Inp | 2396.00 | NIST | |
| Inp | 2396.00 | NIST | |
| Tboil | 862.79 | K | Joback Calculated Property |
| Tc | 1076.96 | K | Joback Calculated Property |
| Tfus | 519.05 | K | Joback Calculated Property |
| Vc | 0.982 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [744.59; 803.66] | J/mol×K | [862.79; 1076.96] |
|
| Cp,gas | 744.59 | J/mol×K | 862.79 | Joback Calculated Property |
| Cp,gas | 757.18 | J/mol×K | 898.49 | Joback Calculated Property |
| Cp,gas | 768.65 | J/mol×K | 934.18 | Joback Calculated Property |
| Cp,gas | 779.03 | J/mol×K | 969.88 | Joback Calculated Property |
| Cp,gas | 788.31 | J/mol×K | 1005.57 | Joback Calculated Property |
| Cp,gas | 796.52 | J/mol×K | 1041.27 | Joback Calculated Property |
| Cp,gas | 803.66 | J/mol×K | 1076.96 | Joback Calculated Property |
| η | [0.0000663; 0.0006723] | Pa×s | [519.05; 862.79] |
|
| η | 0.0006723 | Pa×s | 519.05 | Joback Calculated Property |
| η | 0.0003772 | Pa×s | 576.34 | Joback Calculated Property |
| η | 0.0002349 | Pa×s | 633.63 | Joback Calculated Property |
| η | 0.0001583 | Pa×s | 690.92 | Joback Calculated Property |
| η | 0.0001133 | Pa×s | 748.21 | Joback Calculated Property |
| η | 0.0000850 | Pa×s | 805.50 | Joback Calculated Property |
| η | 0.0000663 | Pa×s | 862.79 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, 2-methylpent-3-yl 4-chloro-2-formylphenyl ester.
Sources
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