- InChI
- InChI=1S/C15H30N2/c1-2-3-4-5-6-7-8-9-10-11-14-17-15-12-13-16/h17H,2-12,14-15H2,1H3
- InChI Key
- DKRQDOPNZFOLQD-UHFFFAOYSA-N
- Formula
- C15H30N2
- SMILES
- CCCCCCCCCCCCNCCC#N
- Molecular Weight1
- 238.41
- CAS
- 4763-40-0
- Other Names
-
- 3-(dodecylamino)propiononitrile
- 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).
- 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 | 0.8248 | Relay (1.0) Calculated Property | |
| ΔfG° | 297.99 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -168.17 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 41.21 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 92.74 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.59 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.36 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.411 | Crippen Calculated Property | |
| McVol | 233.570 | ml/mol | McGowan Calculated Property |
| Pc | 1402.74 | kPa | Joback Calculated Property |
| Tboil | 609.20 | K | Relay (1.0) Calculated Property |
| Tc | 794.83 | K | Relay (1.0) Calculated Property |
| Tfus | 298.95 | K | Relay (1.0) Calculated Property |
| Vc | 0.894 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [672.05; 758.82] | J/mol×K | [694.85; 872.72] | 
|
| Cp,gas | 672.05 | J/mol×K | 694.85 | Joback Calculated Property |
| Cp,gas | 688.35 | J/mol×K | 724.50 | Joback Calculated Property |
| Cp,gas | 703.87 | J/mol×K | 754.14 | Joback Calculated Property |
| Cp,gas | 718.65 | J/mol×K | 783.79 | Joback Calculated Property |
| Cp,gas | 732.72 | J/mol×K | 813.43 | Joback Calculated Property |
| Cp,gas | 746.10 | J/mol×K | 843.08 | Joback Calculated Property |
| Cp,gas | 758.82 | J/mol×K | 872.72 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Propanenitrile, 3-(dodecylamino)-.
Sources
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