- InChI
- InChI=1S/C10H20N2/c1-3-8-12(9-4-2)10-6-5-7-11/h3-6,8-10H2,1-2H3
- InChI Key
- FLJPZKPNJVGMHO-UHFFFAOYSA-N
- Formula
- C10H20N2
- SMILES
- CCCN(CCC)CCCC#N
- Molecular Weight1
- 168.28
- CAS
- 70288-99-2
- Other Names
-
- 4-Di-n-propylaminobutyronitrile
- 4-dipropylaminobutyronitrile
- 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 | 0.5976 | Relay (1.0) Calculated Property | |
| ΔfG° | 277.28 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -41.45 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 26.18 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 66.13 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.72 | eV | Relay (1.0) Calculated Property |
| log10WS | -1.39 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.412 | Crippen Calculated Property | |
| McVol | 163.120 | ml/mol | McGowan Calculated Property |
| Pc | 2056.76 | kPa | Joback Calculated Property |
| Tboil | 514.47 | K | Relay (1.0) Calculated Property |
| Tc | 698.88 | K | Relay (1.0) Calculated Property |
| Tfus | 219.43 | K | Relay (1.0) Calculated Property |
| Vc | 0.595 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [234.50; 549.75] | 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 | 1.07000e-01 | |||
| Coefficient B | 1.01254e+00 | |||
| Coefficient C | -6.01800e-04 | |||
| Coefficient D | 1.38900e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 234.50 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 289.15 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 337.87 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 381.09 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 419.27 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 452.83 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 482.22 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 507.88 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 530.24 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 549.75 | J/mol×K | 1000.00 | Calculated Property |
Similar Compounds
Find more compounds similar to Butanenitrile, 4-(dipropylamino)-.
Sources
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