- InChI
- InChI=1S/C29H48F3NO/c1-3-5-7-9-11-13-15-17-19-23-33(24-20-18-16-14-12-10-8-6-4-2)29(34)25-21-22-26(30)28(32)27(25)31/h21-22H,3-20,23-24H2,1-2H3
- InChI Key
- YZMQZQDHBGAUPC-UHFFFAOYSA-N
- Formula
- C29H48F3NO
- SMILES
-
CCCCCCCCCCCN(CCCCCCCCCCC)C(=O)
c1ccc(F)c(F)c1F - Molecular Weight1
- 483.69
- 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 | 1.2432 | Relay (1.0) Calculated Property | |
| ΔfG° | -325.75 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1018.92 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 77.60 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 126.42 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.90 | eV | Relay (1.0) Calculated Property |
| log10WS | -9.32 | Relay (1.0) Calculated Property | |
| logPoct/wat | 9.608 | Crippen Calculated Property | |
| McVol | 412.570 | ml/mol | McGowan Calculated Property |
| Pc | 696.18 | kPa | Joback Calculated Property |
| Inp | [3153.00; 3153.00] |
|
|
| Inp | 3153.00 | NIST | |
| Inp | 3153.00 | NIST | |
| Tboil | 688.03 | K | Relay (1.0) Calculated Property |
| Tc | 874.44 | K | Relay (1.0) Calculated Property |
| Tfus | 321.21 | K | Relay (1.0) Calculated Property |
| Vc | 1.557 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1417.73; 1529.56] | J/mol×K | [968.66; 1196.62] |
|
| Cp,gas | 1417.73 | J/mol×K | 968.66 | Joback Calculated Property |
| Cp,gas | 1439.84 | J/mol×K | 1006.65 | Joback Calculated Property |
| Cp,gas | 1460.41 | J/mol×K | 1044.65 | Joback Calculated Property |
| Cp,gas | 1479.57 | J/mol×K | 1082.64 | Joback Calculated Property |
| Cp,gas | 1497.40 | J/mol×K | 1120.63 | Joback Calculated Property |
| Cp,gas | 1514.03 | J/mol×K | 1158.63 | Joback Calculated Property |
| Cp,gas | 1529.56 | J/mol×K | 1196.62 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzamide, N,N-diundecyl-2,3,4-trifluoro-.
Sources
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