- InChI
- InChI=1S/C17H35N/c1-3-5-6-7-8-9-10-11-12-13-14-15-17-18-16-4-2/h4,18H,2-3,5-17H2,1H3
- InChI Key
- UPWBYIXAFQMXQJ-UHFFFAOYSA-N
- Formula
- C17H35N
- SMILES
- C=CCNCCCCCCCCCCCCCC
- Molecular Weight1
- 253.47
- 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 | 0.7696 | Relay (1.0) Calculated Property | |
| ΔfG° | 269.49 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -235.99 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 43.60 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 92.35 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.50 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.80 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.463 | Crippen Calculated Property | |
| McVol | 256.070 | ml/mol | McGowan Calculated Property |
| Pc | 1280.08 | kPa | Joback Calculated Property |
| Inp | [2373.00; 2373.00] |
|
|
| Inp | 2373.00 | NIST | |
| Inp | 2373.00 | NIST | |
| Tboil | 589.63 | K | Relay (1.0) Calculated Property |
| Tc | 742.14 | K | Relay (1.0) Calculated Property |
| Tfus | 287.18 | K | Relay (1.0) Calculated Property |
| Vc | 0.976 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [372.49; 904.75] | J/mol×K | [273.00; 1000.00] |
Joback Predicted correlation
|
| Equation | Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K | |||
| Coefficient A | -1.67660e+01 | |||
| Coefficient B | 1.67502e+00 | |||
| Coefficient C | -9.72500e-04 | |||
| Coefficient D | 2.19000e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 372.49 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 463.80 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 545.45 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 618.13 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 682.55 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 739.38 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 789.32 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 833.07 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 871.32 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 904.75 | J/mol×K | 1000.00 | Calculated Property |
Similar Compounds
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Sources
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