- InChI
- InChI=1S/C26H53NO/c1-4-7-10-13-15-18-21-24-27(25-22-19-16-14-11-8-5-2)26(28)23-20-17-12-9-6-3/h4-25H2,1-3H3
- InChI Key
- BTQILVQTQBZOGO-UHFFFAOYSA-N
- Formula
- C26H53NO
- SMILES
-
CCCCCCCCCN(CCCCCCCCC)C(=O)CCCC
CCC - Molecular Weight1
- 395.71
- 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 | 1.1386 | Relay (1.0) Calculated Property | |
| ΔfG° | 149.90 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -704.56 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 67.72 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 111.23 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.53 | eV | Relay (1.0) Calculated Property |
| log10WS | -7.50 | Relay (1.0) Calculated Property | |
| logPoct/wat | 8.677 | Crippen Calculated Property | |
| McVol | 388.750 | ml/mol | McGowan Calculated Property |
| Pc | 749.38 | kPa | Joback Calculated Property |
| Inp | [2789.00; 2789.00] |
|
|
| Inp | 2789.00 | NIST | |
| Inp | 2789.00 | NIST | |
| Tboil | 639.45 | K | Relay (1.0) Calculated Property |
| Tc | 834.75 | K | Relay (1.0) Calculated Property |
| Tfus | 307.73 | K | Relay (1.0) Calculated Property |
| Vc | 1.509 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1296.13; 1418.09] | J/mol×K | [860.59; 1054.80] |
|
| Cp,gas | 1296.13 | J/mol×K | 860.59 | Joback Calculated Property |
| Cp,gas | 1319.43 | J/mol×K | 892.96 | Joback Calculated Property |
| Cp,gas | 1341.45 | J/mol×K | 925.33 | Joback Calculated Property |
| Cp,gas | 1362.26 | J/mol×K | 957.70 | Joback Calculated Property |
| Cp,gas | 1381.93 | J/mol×K | 990.07 | Joback Calculated Property |
| Cp,gas | 1400.51 | J/mol×K | 1022.44 | Joback Calculated Property |
| Cp,gas | 1418.09 | J/mol×K | 1054.80 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Octanamide, N,N-dinonyl-.
Sources
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