- InChI
- InChI=1S/C27H55NO/c1-4-7-10-12-14-16-18-20-22-25-28(27(29)24-9-6-3)26-23-21-19-17-15-13-11-8-5-2/h4-26H2,1-3H3
- InChI Key
- HBEHPZKSJAMBPI-UHFFFAOYSA-N
- Formula
- C27H55NO
- SMILES
-
CCCCCCCCCCCN(CCCCCCCCCCC)C(=O)
CCCC - Molecular Weight1
- 409.73
- 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 | 1.1744 | Relay (1.0) Calculated Property | |
| ΔfG° | 158.32 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -726.11 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 70.31 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 116.21 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.59 | eV | Relay (1.0) Calculated Property |
| log10WS | -7.83 | Relay (1.0) Calculated Property | |
| logPoct/wat | 9.067 | Crippen Calculated Property | |
| McVol | 402.840 | ml/mol | McGowan Calculated Property |
| Pc | 711.49 | kPa | Joback Calculated Property |
| Inp | [2920.00; 2920.00] |
|
|
| Inp | 2920.00 | NIST | |
| Inp | 2920.00 | NIST | |
| Tboil | 644.28 | K | Relay (1.0) Calculated Property |
| Tc | 838.95 | K | Relay (1.0) Calculated Property |
| Tfus | 309.84 | K | Relay (1.0) Calculated Property |
| Vc | 1.565 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1361.50; 1486.88] | J/mol×K | [883.47; 1084.86] |
|
| Cp,gas | 1361.50 | J/mol×K | 883.47 | Joback Calculated Property |
| Cp,gas | 1385.56 | J/mol×K | 917.03 | Joback Calculated Property |
| Cp,gas | 1408.26 | J/mol×K | 950.60 | Joback Calculated Property |
| Cp,gas | 1429.66 | J/mol×K | 984.16 | Joback Calculated Property |
| Cp,gas | 1449.85 | J/mol×K | 1017.73 | Joback Calculated Property |
| Cp,gas | 1468.90 | J/mol×K | 1051.29 | Joback Calculated Property |
| Cp,gas | 1486.88 | J/mol×K | 1084.86 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Pentanamide, N,N-diundecyl-.
Sources
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