- InChI
- InChI=1S/C14H18ClNO4/c1-3-20-14(18)6-4-5-13(17)16-11-9-10(15)7-8-12(11)19-2/h7-9H,3-6H2,1-2H3,(H,16,17)
- InChI Key
- CDUXWNNQFRINAJ-UHFFFAOYSA-N
- Formula
- C14H18ClNO4
- SMILES
-
CCOC(=O)CCCC(=O)Nc1cc(Cl)ccc1O
C - Molecular Weight1
- 299.75
- ω : Acentric Factor.
- 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).
- 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 | 0.8241 | Relay (1.0) Calculated Property | |
| ΔfG° | -230.23 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -716.13 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 40.15 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 98.29 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.01 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.16 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.021 | Crippen Calculated Property | |
| McVol | 221.460 | ml/mol | McGowan Calculated Property |
| Pc | 2079.33 | kPa | Joback Calculated Property |
| Inp | 2601.00 | NIST | |
| Tboil | 628.91 | K | Relay (1.0) Calculated Property |
| Tc | 858.38 | K | Relay (1.0) Calculated Property |
| Tfus | 363.24 | K | Relay (1.0) Calculated Property |
| Vc | 0.799 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [617.45; 678.77] | J/mol×K | [796.54; 1007.40] | 
|
| Cp,gas | 617.45 | J/mol×K | 796.54 | Joback Calculated Property |
| Cp,gas | 630.04 | J/mol×K | 831.68 | Joback Calculated Property |
| Cp,gas | 641.68 | J/mol×K | 866.83 | Joback Calculated Property |
| Cp,gas | 652.36 | J/mol×K | 901.97 | Joback Calculated Property |
| Cp,gas | 662.10 | J/mol×K | 937.11 | Joback Calculated Property |
| Cp,gas | 670.90 | J/mol×K | 972.25 | Joback Calculated Property |
| Cp,gas | 678.77 | J/mol×K | 1007.40 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, monoamide, N-(5-chloro-2-methoxyphenyl)-, ethyl ester.
Sources
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