- InChI
- InChI=1S/C10H19NO2/c1-10(2,3)9(12)11-7-8-5-4-6-13-8/h8H,4-7H2,1-3H3,(H,11,12)
- InChI Key
- ZZVZNLVJFFYOPZ-UHFFFAOYSA-N
- Formula
- C10H19NO2
- SMILES
- CC(C)(C)C(=O)NCC1CCCO1
- Molecular Weight1
- 185.26
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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).
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- 1: Molecular weight from the IUPAC atomic weights tables.
Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfH°gas | -480.99 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 22.85 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 68.99 | kJ/mol | Relay (1.0) Calculated Property |
| logPoct/wat | 1.328 | Crippen Calculated Property | |
| McVol | 158.320 | ml/mol | McGowan Calculated Property |
| Inp | 1381.00 | NIST | |
| Tboil | 526.21 | K | Relay (1.0) Calculated Property |
| Tfus | 289.73 | K | Relay (1.0) Calculated Property |
Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [217.40; 565.43] | 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 | -6.76890e+01 | |||
| Coefficient B | 1.25656e+00 | |||
| Coefficient C | -8.35400e-04 | |||
| Coefficient D | 2.11960e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 217.40 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 281.68 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 337.99 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 387.01 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 429.40 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 465.84 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 496.99 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 523.52 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 546.11 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 565.43 | J/mol×K | 1000.00 | Calculated Property |
Similar Compounds
Find more compounds similar to Propanamide, N-tetrahydrofurfuryl-2,2-dimethyl-.
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more.
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