- InChI
- InChI=1S/C14H10F2N2O4/c15-11-5-3-9(13(7-11)17(19)20)1-2-10-4-6-12(16)8-14(10)18(21)22/h3-8H,1-2H2
- InChI Key
- NRDWMCMPPQKQMY-UHFFFAOYSA-N
- Formula
- C14H10F2N2O4
- SMILES
-
O=[N+]([O-])c1cc(F)ccc1CCc1ccc
(F)cc1[N+](=O)[O-] - Molecular Weight1
- 308.24
- CAS
- 50618-92-3
- Other Names
-
- 4,4'-difluoro-2,2'-dinitrobibenzyl
- 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).
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | -65.22 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -318.85 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 47.42 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 85.51 | kJ/mol | Joback Calculated Property |
| log10WS | -5.85 | Crippen Calculated Property | |
| logPoct/wat | 3.566 | Crippen Calculated Property | |
| McVol | 198.980 | ml/mol | McGowan Calculated Property |
| Pc | 2436.25 | kPa | Joback Calculated Property |
| Tboil | 895.22 | K | Joback Calculated Property |
| Tc | 1152.50 | K | Joback Calculated Property |
| Tfus | 638.86 | K | Joback Calculated Property |
| Vc | 0.803 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [576.19; 622.71] | J/mol×K | [895.22; 1152.50] | 
|
| Cp,gas | 576.19 | J/mol×K | 895.22 | Joback Calculated Property |
| Cp,gas | 586.25 | J/mol×K | 938.10 | Joback Calculated Property |
| Cp,gas | 595.29 | J/mol×K | 980.98 | Joback Calculated Property |
| Cp,gas | 603.38 | J/mol×K | 1023.86 | Joback Calculated Property |
| Cp,gas | 610.60 | J/mol×K | 1066.74 | Joback Calculated Property |
| Cp,gas | 617.02 | J/mol×K | 1109.62 | Joback Calculated Property |
| Cp,gas | 622.71 | J/mol×K | 1152.50 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Dibenzyl, 4,4'-difluoro-2,2'-dinitro-.
Sources
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