- InChI
- InChI=1S/C2H4N2O5/c5-3(6)1-2-9-4(7)8/h1-2H2
- InChI Key
- FRXFYZJACNONHT-UHFFFAOYSA-N
- Formula
- C2H4N2O5
- SMILES
- O=[N+]([O-])CCO[N+](=O)[O-]
- Molecular Weight1
- 136.06
- CAS
- 4528-34-1
- Other Names
-
- 2-Nitroethyl nitrate
- Ethanol, 2-nitro-, nitrate
- Nitroethyl nitrate
- ΔcH°liquid : Standard liquid enthalpy of combustion (kJ/mol).
- 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 |
|---|---|---|---|
| ΔcH°liquid | -927.17 | kJ/mol | NIST |
| ΔfG° | -67.94 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -238.35 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 24.85 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 55.64 | kJ/mol | Joback Calculated Property |
| log10WS | -0.91 | Crippen Calculated Property | |
| logPoct/wat | -0.529 | Crippen Calculated Property | |
| McVol | 79.750 | ml/mol | McGowan Calculated Property |
| Pc | 5080.25 | kPa | Joback Calculated Property |
| Tboil | 571.26 | K | Joback Calculated Property |
| Tc | 815.08 | K | Joback Calculated Property |
| Tfus | 421.75 | K | Joback Calculated Property |
| Vc | 0.330 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [182.51; 217.67] | J/mol×K | [571.26; 815.08] | 
|
| Cp,gas | 182.51 | J/mol×K | 571.26 | Joback Calculated Property |
| Cp,gas | 189.49 | J/mol×K | 611.90 | Joback Calculated Property |
| Cp,gas | 196.03 | J/mol×K | 652.53 | Joback Calculated Property |
| Cp,gas | 202.11 | J/mol×K | 693.17 | Joback Calculated Property |
| Cp,gas | 207.75 | J/mol×K | 733.80 | Joback Calculated Property |
| Cp,gas | 212.93 | J/mol×K | 774.44 | Joback Calculated Property |
| Cp,gas | 217.67 | J/mol×K | 815.08 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Ethanol, 2-nitro-, nitrate (ester).
Sources
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