- InChI
- InChI=1S/C21H43N/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-22-20-4-2/h4,22H,2-3,5-21H2,1H3
- InChI Key
- NZDBTPVECFIJKC-UHFFFAOYSA-N
- Formula
- C21H43N
- SMILES
- C=CCNCCCCCCCCCCCCCCCCCC
- Molecular Weight1
- 309.57
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | 303.17 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -297.87 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 53.96 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 68.11 | kJ/mol | Joback Calculated Property |
| log10WS | -7.66 | Crippen Calculated Property | |
| logPoct/wat | 7.024 | Crippen Calculated Property | |
| McVol | 312.430 | ml/mol | McGowan Calculated Property |
| Pc | 989.51 | kPa | Joback Calculated Property |
| Inp | 1088.00 | NIST | |
| Tboil | 726.73 | K | Joback Calculated Property |
| Tc | 895.81 | K | Joback Calculated Property |
| Tfus | 377.33 | K | Joback Calculated Property |
| Vc | 1.228 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [946.83; 1057.13] | J/mol×K | [726.73; 895.81] | 
|
| Cp,gas | 946.83 | J/mol×K | 726.73 | Joback Calculated Property |
| Cp,gas | 967.42 | J/mol×K | 754.91 | Joback Calculated Property |
| Cp,gas | 987.08 | J/mol×K | 783.09 | Joback Calculated Property |
| Cp,gas | 1005.85 | J/mol×K | 811.27 | Joback Calculated Property |
| Cp,gas | 1023.75 | J/mol×K | 839.45 | Joback Calculated Property |
| Cp,gas | 1040.83 | J/mol×K | 867.63 | Joback Calculated Property |
| Cp,gas | 1057.13 | J/mol×K | 895.81 | Joback Calculated Property |
Similar Compounds
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Sources
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