- InChI
- InChI=1S/CBr3NO2/c2-1(3,4)5(6)7
- InChI Key
- QQZIUHOKWDFXEY-UHFFFAOYSA-N
- Formula
- CBr3NO2
- SMILES
- O=[N+]([O-])C(Br)(Br)Br
- Molecular Weight1
- 297.73
- CAS
- 464-10-8
- 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).
- 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 | 0.4871 | Relay (1.0) Calculated Property | |
| ΔfG° | 38.89 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 92.92 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 18.15 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 53.80 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 11.04 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.01 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.059 | Crippen Calculated Property | |
| McVol | 94.870 | ml/mol | McGowan Calculated Property |
| Pc | 8637.25 | kPa | Joback Calculated Property |
| Tboil | 457.78 | K | Relay (1.0) Calculated Property |
| Tc | 692.17 | K | Relay (1.0) Calculated Property |
| Tfus | 241.95 | K | Relay (1.0) Calculated Property |
| Vc | 0.341 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [132.74; 142.45] | J/mol×K | [569.37; 858.80] | 
|
| Cp,gas | 132.74 | J/mol×K | 569.37 | Joback Calculated Property |
| Cp,gas | 135.48 | J/mol×K | 617.61 | Joback Calculated Property |
| Cp,gas | 137.60 | J/mol×K | 665.85 | Joback Calculated Property |
| Cp,gas | 139.22 | J/mol×K | 714.08 | Joback Calculated Property |
| Cp,gas | 140.49 | J/mol×K | 762.32 | Joback Calculated Property |
| Cp,gas | 141.52 | J/mol×K | 810.56 | Joback Calculated Property |
| Cp,gas | 142.45 | J/mol×K | 858.80 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to tribromonitromethane.
Sources
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