- InChI
- InChI=1S/C11H25N/c1-4-7-10-12(9-6-3)11-8-5-2/h4-11H2,1-3H3
- InChI Key
- VEBPYKMCKZTFPJ-UHFFFAOYSA-N
- Formula
- C11H25N
- SMILES
- CCCCN(CCC)CCCC
- Molecular Weight1
- 171.32
- CAS
- 36874-77-8
- Other Names
-
- N-Propyldibutylamine
- 1-Butanamine, N-butyl-N-propyl-
- Dibutyl propyl amine
- NSC 13550
- 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 | 0.5335 | Relay (1.0) Calculated Property | |
| ΔfG° | 152.52 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -208.03 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 27.27 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 54.67 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.41 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.79 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.299 | Crippen Calculated Property | |
| McVol | 175.830 | ml/mol | McGowan Calculated Property |
| Pc | 1930.44 | kPa | Joback Calculated Property |
| Inp | [1085.60; 1088.00] |
|
|
| Inp | 1088.00 | NIST | |
| Inp | 1085.60 | NIST | |
| Tboil | 460.43 | K | Relay (1.0) Calculated Property |
| Tc | 624.42 | K | Relay (1.0) Calculated Property |
| Tfus | 185.89 | K | Relay (1.0) Calculated Property |
| Vc | 0.663 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [254.34; 624.86] | 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 | -1.78020e+01 | |||
| Coefficient B | 1.17276e+00 | |||
| Coefficient C | -6.87200e-04 | |||
| Coefficient D | 1.57100e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 254.34 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 318.04 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 374.95 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 425.56 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 470.38 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 509.89 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 544.60 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 575.00 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 601.58 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 624.86 | J/mol×K | 1000.00 | Calculated Property |
Similar Compounds
Find more compounds similar to N-Butyl-N-propyl-1-butanamine.
Sources
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