- InChI
- InChI=1S/C16H33NO2/c1-4-5-6-7-8-9-10-11-14-19-16(18)17-13-12-15(2)3/h15H,4-14H2,1-3H3,(H,17,18)
- InChI Key
- ROIAJOMXQLTKTM-UHFFFAOYSA-N
- Formula
- C16H33NO2
- SMILES
- CCCCCCCCCCOC(=O)NCCC(C)C
- Molecular Weight1
- 271.44
- 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 | 0.8688 | Relay (1.0) Calculated Property | |
| ΔfG° | -139.58 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -712.83 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 43.14 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 92.87 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.26 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.09 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.899 | Crippen Calculated Property | |
| McVol | 253.720 | ml/mol | McGowan Calculated Property |
| Pc | 1343.73 | kPa | Joback Calculated Property |
| Inp | [2112.00; 2112.00] |
|
|
| Inp | 2112.00 | NIST | |
| Inp | 2112.00 | NIST | |
| Tboil | 574.23 | K | Relay (1.0) Calculated Property |
| Tc | 768.31 | K | Relay (1.0) Calculated Property |
| Tfus | 269.01 | K | Relay (1.0) Calculated Property |
| Vc | 0.964 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [731.40; 827.12] | J/mol×K | [673.63; 844.49] |
|
| Cp,gas | 731.40 | J/mol×K | 673.63 | Joback Calculated Property |
| Cp,gas | 749.42 | J/mol×K | 702.11 | Joback Calculated Property |
| Cp,gas | 766.59 | J/mol×K | 730.58 | Joback Calculated Property |
| Cp,gas | 782.93 | J/mol×K | 759.06 | Joback Calculated Property |
| Cp,gas | 798.45 | J/mol×K | 787.53 | Joback Calculated Property |
| Cp,gas | 813.17 | J/mol×K | 816.01 | Joback Calculated Property |
| Cp,gas | 827.12 | J/mol×K | 844.49 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Carbonic acid, monoamide, N-3-methylbutyl-, decyl ester.
Sources
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