- InChI
- InChI=1S/C6H13NO/c1-5(2)4-7-6(3)8/h5H,4H2,1-3H3,(H,7,8)
- InChI Key
- VDQMVRFHUYAKJL-UHFFFAOYSA-N
- Formula
- C6H13NO
- SMILES
- CC(=O)NCC(C)C
- Molecular Weight1
- 115.17
- CAS
- 1540-94-9
- Other Names
-
- Acetamide, N-isobutyl-
- N-(2-Methylpropyl)acetamide
- N-Isobutylacetamide
- N-(2-Methyl-propyl)ethanamide
- N-(2-Methyl-2-propyl)ethanamide
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- Cp,solid : Solid phase 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° | -42.33 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -231.56 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 14.47 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 41.74 | kJ/mol | Joback Calculated Property |
| log10WS | -1.06 | Crippen Calculated Property | |
| logPoct/wat | 0.778 | Crippen Calculated Property | |
| McVol | 106.950 | ml/mol | McGowan Calculated Property |
| Pc | 3419.86 | kPa | Joback Calculated Property |
| Inp | [998.00; 1027.00] |
|
|
| Inp | 1013.00 | NIST | |
| Inp | 998.00 | NIST | |
| Inp | 1027.00 | NIST | |
| I | [1690.00; 1731.00] |
|
|
| I | 1731.00 | NIST | |
| I | 1690.00 | NIST | |
| Tboil | 440.28 | K | Joback Calculated Property |
| Tc | 626.32 | K | Joback Calculated Property |
| Tfus | 244.97 | K | Joback Calculated Property |
| Vc | 0.406 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [218.52; 278.54] | J/mol×K | [440.28; 626.32] |
|
| Cp,gas | 218.52 | J/mol×K | 440.28 | Joback Calculated Property |
| Cp,gas | 229.69 | J/mol×K | 471.29 | Joback Calculated Property |
| Cp,gas | 240.37 | J/mol×K | 502.29 | Joback Calculated Property |
| Cp,gas | 250.59 | J/mol×K | 533.30 | Joback Calculated Property |
| Cp,gas | 260.35 | J/mol×K | 564.30 | Joback Calculated Property |
| Cp,gas | 269.67 | J/mol×K | 595.31 | Joback Calculated Property |
| Cp,gas | 278.54 | J/mol×K | 626.32 | Joback Calculated Property |
| Cp,solid | 190.00 | J/mol×K | 298.15 | NIST |
Similar Compounds
Find more compounds similar to Acetamide, N-(2-methylpropyl)-.
Sources
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