- InChI
- InChI=1S/C9H19NO/c1-7(2)5-9(11)10-6-8(3)4/h7-8H,5-6H2,1-4H3,(H,10,11)
- InChI Key
- BPDCZYLPNNLOBD-UHFFFAOYSA-N
- Formula
- C9H19NO
- SMILES
- CC(C)CNC(=O)CC(C)C
- Molecular Weight1
- 157.25
- 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.
- 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° | -19.51 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -298.76 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 18.72 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 48.03 | kJ/mol | Joback Calculated Property |
| log10WS | -2.07 | Crippen Calculated Property | |
| logPoct/wat | 1.805 | Crippen Calculated Property | |
| McVol | 149.220 | ml/mol | McGowan Calculated Property |
| Pc | 2525.19 | kPa | Joback Calculated Property |
| Inp | 1218.00 | NIST | |
| Tboil | 508.48 | K | Joback Calculated Property |
| Tc | 692.88 | K | Joback Calculated Property |
| Tfus | 263.78 | K | Joback Calculated Property |
| Vc | 0.569 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [347.57; 425.17] | J/mol×K | [508.48; 692.88] | 
|
| Cp,gas | 347.57 | J/mol×K | 508.48 | Joback Calculated Property |
| Cp,gas | 362.09 | J/mol×K | 539.21 | Joback Calculated Property |
| Cp,gas | 375.94 | J/mol×K | 569.95 | Joback Calculated Property |
| Cp,gas | 389.16 | J/mol×K | 600.68 | Joback Calculated Property |
| Cp,gas | 401.76 | J/mol×K | 631.41 | Joback Calculated Property |
| Cp,gas | 413.76 | J/mol×K | 662.15 | Joback Calculated Property |
| Cp,gas | 425.17 | J/mol×K | 692.88 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Butanamide, N-isobutyl-3-methyl.
Sources
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