- InChI
- InChI=1S/C22H43NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24/h9-10H,2-8,11-21H2,1H3,(H2,23,24)/b10-9-
- InChI Key
- UAUDZVJPLUQNMU-KTKRTIGZSA-N
- Formula
- C22H43NO
- SMILES
- CCCCCCCCC=CCCCCCCCCCCCC(N)=O
- Molecular Weight1
- 337.58
- CAS
- 112-84-5
- Other Names
-
- Erucylamide
- (Z)-13-Docosenamide
- 13-Docosenamide, cis-
- Armid E
- cis-13-Docosenamide
- cis-13-Docosenoamide
- Crodamide E
- Erucamide
- Erucic acid amide
- Kemamide E
- Petrac eramide
- Polydis TR 131
- Unislip 1753
- Euracamide
- Crodamide ER
- (Z)-docos-13-enamide
- 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 | 1.0666 | Relay (1.0) Calculated Property | |
| ΔfG° | 152.11 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -644.34 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 59.73 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 123.15 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.31 | eV | Relay (1.0) Calculated Property |
| log10WS | -7.25 | Relay (1.0) Calculated Property | |
| logPoct/wat | 7.070 | Crippen Calculated Property | |
| McVol | 328.090 | ml/mol | McGowan Calculated Property |
| Pc | 1002.71 | kPa | Joback Calculated Property |
| Inp | [2625.00; 2625.00] |
|
|
| Inp | 2625.00 | NIST | |
| Inp | 2625.00 | NIST | |
| Inp | 2625.00 | NIST | |
| Inp | 2625.00 | NIST | |
| Inp | 2625.00 | NIST | |
| Inp | 2625.00 | NIST | |
| Inp | 2625.00 | NIST | |
| Tboil | 630.38 | K | Relay (1.0) Calculated Property |
| Tc | 836.83 | K | Relay (1.0) Calculated Property |
| Tfus | 330.44 | K | Relay (1.0) Calculated Property |
| Vc | 1.250 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1055.97; 1159.33] | J/mol×K | [833.32; 1022.23] |
|
| Cp,gas | 1055.97 | J/mol×K | 833.32 | Joback Calculated Property |
| Cp,gas | 1075.51 | J/mol×K | 864.80 | Joback Calculated Property |
| Cp,gas | 1094.04 | J/mol×K | 896.29 | Joback Calculated Property |
| Cp,gas | 1111.63 | J/mol×K | 927.77 | Joback Calculated Property |
| Cp,gas | 1128.34 | J/mol×K | 959.26 | Joback Calculated Property |
| Cp,gas | 1144.22 | J/mol×K | 990.74 | Joback Calculated Property |
| Cp,gas | 1159.33 | J/mol×K | 1022.23 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 13-Docosenamide, (Z)-.
Sources
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