- InChI
- InChI=1S/C13H27NO/c1-3-4-5-6-7-8-9-10-11-12-13(15)14-2/h3-12H2,1-2H3,(H,14,15)
- InChI Key
- APWSJINSLHHRPD-UHFFFAOYSA-N
- Formula
- C13H27NO
- SMILES
- CCCCCCCCCCCC(=O)NC
- Molecular Weight1
- 213.37
- 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).
- ΔsubH : Enthalpy of sublimation at a given temperature (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).
- 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 | 0.7548 | Relay (1.0) Calculated Property | |
| ΔfG° | 19.05 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -462.27 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 36.12 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 88.08 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.27 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.92 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.653 | Crippen Calculated Property | |
| McVol | 205.580 | ml/mol | McGowan Calculated Property |
| Pc | 1750.67 | kPa | Joback Calculated Property |
| Tboil | 552.30 | K | Relay (1.0) Calculated Property |
| Tc | 757.72 | K | Relay (1.0) Calculated Property |
| Tfus | 341.00 ± 3.00 | K | NIST |
| Vc | 0.795 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| ΔsubH | 116.60 ± 0.80 | kJ/mol | 330.00 | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [298.37; 715.92] | 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 | -2.78000e+00 | |||
| Coefficient B | 1.28704e+00 | |||
| Coefficient C | -7.13300e-04 | |||
| Coefficient D | 1.44960e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 298.37 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 369.69 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 433.71 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 490.88 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 541.68 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 586.54 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 625.94 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 660.33 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 690.17 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 715.92 | J/mol×K | 1000.00 | Calculated Property |
Similar Compounds
Find more compounds similar to N-Methyldodecanamide.
Sources
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