- InChI
- InChI=1S/C7H17N/c1-4-5-8-6-7(2)3/h7-8H,4-6H2,1-3H3
- InChI Key
- SQGSVBHTFQOZDL-UHFFFAOYSA-N
- Formula
- C7H17N
- SMILES
- CCCNCC(C)C
- Molecular Weight1
- 115.22
- CAS
- 39190-66-4
- Other Names
-
- (2-Methyl-n-propyl)-1-propanamine
- Propylisobutylamine
- N-Isobutyl-N-propylamine
- isobutyl-n-propyl-amine
- 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.
- I : 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° | 95.01 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -139.62 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 15.46 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 37.22 | kJ/mol | Joback Calculated Property |
| log10WS | -1.70 | Crippen Calculated Property | |
| logPoct/wat | 1.642 | Crippen Calculated Property | |
| McVol | 119.470 | ml/mol | McGowan Calculated Property |
| Pc | 2862.74 | kPa | Joback Calculated Property |
| Inp | [797.00; 797.00] |
|
|
| Inp | 797.00 | NIST | |
| Inp | 797.00 | NIST | |
| I | [918.00; 918.00] |
|
|
| I | 918.00 | NIST | |
| I | 918.00 | NIST | |
| Tboil | 397.15 ± 2.00 | K | NIST |
| Tc | 582.34 | K | Joback Calculated Property |
| Tfus | 206.31 | K | Joback Calculated Property |
| Vc | 0.457 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [238.14; 308.53] | J/mol×K | [409.29; 582.34] |
|
| Cp,gas | 238.14 | J/mol×K | 409.29 | Joback Calculated Property |
| Cp,gas | 251.08 | J/mol×K | 438.13 | Joback Calculated Property |
| Cp,gas | 263.53 | J/mol×K | 466.97 | Joback Calculated Property |
| Cp,gas | 275.48 | J/mol×K | 495.82 | Joback Calculated Property |
| Cp,gas | 286.96 | J/mol×K | 524.66 | Joback Calculated Property |
| Cp,gas | 297.97 | J/mol×K | 553.50 | Joback Calculated Property |
| Cp,gas | 308.53 | J/mol×K | 582.34 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Isobutyl-propyl-amine.
Sources
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