- InChI
- InChI=1S/C19H28ClNO4/c1-3-4-5-6-7-13-25-19(23)10-8-9-18(22)21-16-14-15(20)11-12-17(16)24-2/h11-12,14H,3-10,13H2,1-2H3,(H,21,22)
- InChI Key
- HTPHMGFUMIZDJM-UHFFFAOYSA-N
- Formula
- C19H28ClNO4
- SMILES
-
CCCCCCCOC(=O)CCCC(=O)Nc1cc(Cl)
ccc1OC - Molecular Weight1
- 369.88
- 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 | 1.0258 | Relay (1.0) Calculated Property | |
| ΔfG° | -188.13 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -818.61 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 53.10 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 110.03 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.04 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.03 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.971 | Crippen Calculated Property | |
| McVol | 291.910 | ml/mol | McGowan Calculated Property |
| Pc | 1399.59 | kPa | Joback Calculated Property |
| Inp | 3108.00 | NIST | |
| Tboil | 662.89 | K | Relay (1.0) Calculated Property |
| Tc | 897.54 | K | Relay (1.0) Calculated Property |
| Tfus | 355.44 | K | Relay (1.0) Calculated Property |
| Vc | 1.064 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [902.36; 967.93] | J/mol×K | [910.94; 1121.43] | 
|
| Cp,gas | 902.36 | J/mol×K | 910.94 | Joback Calculated Property |
| Cp,gas | 916.18 | J/mol×K | 946.02 | Joback Calculated Property |
| Cp,gas | 928.82 | J/mol×K | 981.10 | Joback Calculated Property |
| Cp,gas | 940.30 | J/mol×K | 1016.18 | Joback Calculated Property |
| Cp,gas | 950.63 | J/mol×K | 1051.27 | Joback Calculated Property |
| Cp,gas | 959.83 | J/mol×K | 1086.35 | Joback Calculated Property |
| Cp,gas | 967.93 | J/mol×K | 1121.43 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, monoamide, N-(5-chloro-2-methoxyphenyl)-, heptyl ester.
Sources
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