- InChI
- InChI=1S/C23H35ClO4/c1-5-8-9-10-11-12-13-16-27-21(25)23(6-2,7-3)22(26)28-20-17-18(4)14-15-19(20)24/h14-15,17H,5-13,16H2,1-4H3
- InChI Key
- NCYGPRGBVFBWRO-UHFFFAOYSA-N
- Formula
- C23H35ClO4
- SMILES
-
CCCCCCCCCOC(=O)C(CC)(CC)C(=O)O
c1cc(C)ccc1Cl - Molecular Weight1
- 410.98
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 0.9886 | Relay (1.0) Calculated Property | |
| ΔfG° | -241.00 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -918.78 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 50.95 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 112.18 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.24 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.57 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.654 | Crippen Calculated Property | |
| McVol | 338.290 | ml/mol | McGowan Calculated Property |
| Pc | 1074.28 | kPa | Joback Calculated Property |
| Inp | 2622.00 | NIST | |
| Tboil | 646.29 | K | Relay (1.0) Calculated Property |
| Tc | 877.62 | K | Relay (1.0) Calculated Property |
| Tfus | 328.87 | K | Relay (1.0) Calculated Property |
| Vc | 1.226 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1084.39; 1159.81] | J/mol×K | [949.06; 1164.53] | 
|
| Cp,gas | 1084.39 | J/mol×K | 949.06 | Joback Calculated Property |
| Cp,gas | 1099.96 | J/mol×K | 984.97 | Joback Calculated Property |
| Cp,gas | 1114.25 | J/mol×K | 1020.88 | Joback Calculated Property |
| Cp,gas | 1127.33 | J/mol×K | 1056.79 | Joback Calculated Property |
| Cp,gas | 1139.25 | J/mol×K | 1092.70 | Joback Calculated Property |
| Cp,gas | 1150.06 | J/mol×K | 1128.62 | Joback Calculated Property |
| Cp,gas | 1159.81 | J/mol×K | 1164.53 | Joback Calculated Property |
| η | [0.0000236; 0.0002646] | Pa×s | [577.09; 949.06] |
|
| η | 0.0002646 | Pa×s | 577.09 | Joback Calculated Property |
| η | 0.0001455 | Pa×s | 639.08 | Joback Calculated Property |
| η | 0.0000890 | Pa×s | 701.08 | Joback Calculated Property |
| η | 0.0000589 | Pa×s | 763.07 | Joback Calculated Property |
| η | 0.0000415 | Pa×s | 825.07 | Joback Calculated Property |
| η | 0.0000307 | Pa×s | 887.06 | Joback Calculated Property |
| η | 0.0000236 | Pa×s | 949.06 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diethylmalonic acid, 2-chloro-5-methylphenyl nonyl ester.
Sources
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