- InChI
- InChI=1S/C29H50FNO/c1-3-5-7-9-11-13-15-17-19-24-31(29(32)27-22-21-23-28(30)26-27)25-20-18-16-14-12-10-8-6-4-2/h21-23,26H,3-20,24-25H2,1-2H3
- InChI Key
- AIHBUJAJYUBOAW-UHFFFAOYSA-N
- Formula
- C29H50FNO
- SMILES
-
CCCCCCCCCCCN(CCCCCCCCCCC)C(=O)
c1cccc(F)c1 - Molecular Weight1
- 447.71
- 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 | 1.2091 | Relay (1.0) Calculated Property | |
| ΔfG° | 83.13 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -718.65 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 72.22 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 126.55 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.78 | eV | Relay (1.0) Calculated Property |
| log10WS | -8.83 | Relay (1.0) Calculated Property | |
| logPoct/wat | 9.330 | Crippen Calculated Property | |
| McVol | 409.030 | ml/mol | McGowan Calculated Property |
| Pc | 742.45 | kPa | Joback Calculated Property |
| Inp | [3260.00; 3260.00] |
|
|
| Inp | 3260.00 | NIST | |
| Inp | 3260.00 | NIST | |
| Tboil | 692.96 | K | Relay (1.0) Calculated Property |
| Tc | 891.65 | K | Relay (1.0) Calculated Property |
| Tfus | 312.50 | K | Relay (1.0) Calculated Property |
| Vc | 1.545 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1404.18; 1516.78] | J/mol×K | [960.16; 1179.28] |
|
| Cp,gas | 1404.18 | J/mol×K | 960.16 | Joback Calculated Property |
| Cp,gas | 1426.10 | J/mol×K | 996.68 | Joback Calculated Property |
| Cp,gas | 1446.61 | J/mol×K | 1033.20 | Joback Calculated Property |
| Cp,gas | 1465.83 | J/mol×K | 1069.72 | Joback Calculated Property |
| Cp,gas | 1483.86 | J/mol×K | 1106.24 | Joback Calculated Property |
| Cp,gas | 1500.81 | J/mol×K | 1142.76 | Joback Calculated Property |
| Cp,gas | 1516.78 | J/mol×K | 1179.28 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzamide, N,N-diundecyl-3-fluoro-.
Sources
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