- InChI
- InChI=1S/CH2NO2/c1-2(3)4/h1H2
- InChI Key
- VUHWIBLKRDNZSP-UHFFFAOYSA-N
- Formula
- CH2NO2
- SMILES
- [CH2][N+](=O)[O-]
- Molecular Weight1
- 60.03
- CAS
- 16787-85-2
- 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 | 0.3710 | Relay (... Calculated Property | |
| ΔfG° | 45.47 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -16.92 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 11.39 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 32.04 | kJ/mol | Relay (... Calculated Property |
| IE | 10.56 | eV | Relay (... Calculated Property |
| log10WS | 0.10 | Relay (... Calculated Property | |
| logPoct/wat | 0.055 | Crippen Calculated Property | |
| McVol | 40.220 | ml/mol | McGowan Calculated Property |
| Pc | 6318.86 | kPa | Joback Calculated Property |
| Tboil | 369.17 | K | Relay (... Calculated Property |
| Tc | 556.96 | K | Relay (... Calculated Property |
| Tfus | 224.73 | K | Relay (... Calculated Property |
| Vc | 0.156 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [62.16; 80.74] | J/mol×K | [373.42; 583.02] | 
|
| Cp,gas | 62.16 | J/mol×K | 373.42 | Joback Calculated Property |
| Cp,gas | 66.11 | J/mol×K | 408.35 | Joback Calculated Property |
| Cp,gas | 69.68 | J/mol×K | 443.29 | Joback Calculated Property |
| Cp,gas | 72.89 | J/mol×K | 478.22 | Joback Calculated Property |
| Cp,gas | 75.78 | J/mol×K | 513.15 | Joback Calculated Property |
| Cp,gas | 78.39 | J/mol×K | 548.09 | Joback Calculated Property |
| Cp,gas | 80.74 | J/mol×K | 583.02 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to CH2NO2.
Sources
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