- InChI
- InChI=1S/C13H27NO/c1-5-7-9-10-12(3)14(13(4)15)11-8-6-2/h12H,5-11H2,1-4H3
- InChI Key
- DHSHWQBXZOGTTG-UHFFFAOYSA-N
- Formula
- C13H27NO
- SMILES
- CCCCCC(C)N(CCCC)C(C)=O
- Molecular Weight1
- 213.36
- 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 | 0.6282 | Relay (1.0) Calculated Property | |
| ΔfG° | 38.00 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -439.48 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 30.52 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 72.35 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.24 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.88 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.604 | Crippen Calculated Property | |
| McVol | 205.580 | ml/mol | McGowan Calculated Property |
| Pc | 1740.46 | kPa | Joback Calculated Property |
| Inp | [1713.00; 1713.00] |
|
|
| Inp | 1713.00 | NIST | |
| Inp | 1713.00 | NIST | |
| Tboil | 539.70 | K | Relay (1.0) Calculated Property |
| Tc | 720.13 | K | Relay (1.0) Calculated Property |
| Tfus | 262.63 | K | Relay (1.0) Calculated Property |
| Vc | 0.758 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [523.86; 617.08] | J/mol×K | [562.71; 733.36] |
|
| Cp,gas | 523.86 | J/mol×K | 562.71 | Joback Calculated Property |
| Cp,gas | 541.25 | J/mol×K | 591.15 | Joback Calculated Property |
| Cp,gas | 557.86 | J/mol×K | 619.59 | Joback Calculated Property |
| Cp,gas | 573.73 | J/mol×K | 648.04 | Joback Calculated Property |
| Cp,gas | 588.87 | J/mol×K | 676.48 | Joback Calculated Property |
| Cp,gas | 603.31 | J/mol×K | 704.92 | Joback Calculated Property |
| Cp,gas | 617.08 | J/mol×K | 733.36 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Acetamide, N-butyl-N-hept-2-yl-.
Sources
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