- InChI
- InChI=1S/C22H31NO4/c1-2-3-14-23(15-19(24)17-26-21-10-6-4-7-11-21)16-20(25)18-27-22-12-8-5-9-13-22/h4-13,19-20,24-25H,2-3,14-18H2,1H3
- InChI Key
- ZDRJSLHBNGHXNK-UHFFFAOYSA-N
- Formula
- C22H31NO4
- SMILES
-
CCCCN(CC(O)COc1ccccc1)CC(O)COc
1ccccc1 - Molecular Weight1
- 373.49
- CAS
- 23257-62-7
- 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).
- ΔsubH : Enthalpy of sublimation at a given temperature (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).
- 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 | 1.0792 | Relay (1.0) Calculated Property | |
| ΔfG° | -18.56 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -569.19 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 47.34 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 140.51 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.74 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.60 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.968 | Crippen Calculated Property | |
| McVol | 306.780 | ml/mol | McGowan Calculated Property |
| Pc | 1594.89 | kPa | Joback Calculated Property |
| Tboil | 721.42 | K | Relay (1.0) Calculated Property |
| Tc | 932.24 | K | Relay (1.0) Calculated Property |
| Tfus | 354.18 | K | Relay (1.0) Calculated Property |
| Vc | 1.110 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1029.57; 1093.34] | J/mol×K | [996.88; 1220.51] | 
|
| Cp,gas | 1029.57 | J/mol×K | 996.88 | Joback Calculated Property |
| Cp,gas | 1042.88 | J/mol×K | 1034.15 | Joback Calculated Property |
| Cp,gas | 1055.02 | J/mol×K | 1071.42 | Joback Calculated Property |
| Cp,gas | 1066.06 | J/mol×K | 1108.70 | Joback Calculated Property |
| Cp,gas | 1076.07 | J/mol×K | 1145.97 | Joback Calculated Property |
| Cp,gas | 1085.14 | J/mol×K | 1183.24 | Joback Calculated Property |
| Cp,gas | 1093.34 | J/mol×K | 1220.51 | Joback Calculated Property |
| ΔsubH | 114.30 | kJ/mol | 387.00 | NIST |
Similar Compounds
![Morpholine, 4-[3-(4-butoxyphenoxy)propyl]-.](data:image/png;base64,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)
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Sources
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