- InChI
- InChI=1S/C4H6N4O12/c9-5(10)17-1-3(19-7(13)14)4(20-8(15)16)2-18-6(11)12/h3-4H,1-2H2
- InChI Key
- SNFOERUNNSHUGP-UHFFFAOYSA-N
- Formula
- C4H6N4O12
- SMILES
-
O=[N+]([O-])OCC(O[N+](=O)[O-])
C(CO[N+](=O)[O-])O[N+](=O)[O-] - Molecular Weight1
- 302.11
- CAS
- 142435-64-1
- 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° | -299.88 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -708.37 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 49.27 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 99.73 | kJ/mol | Joback Calculated Property |
| log10WS | -2.37 | Crippen Calculated Property | |
| logPoct/wat | -1.443 | Crippen Calculated Property | |
| McVol | 160.380 | ml/mol | McGowan Calculated Property |
| Pc | 3877.12 | kPa | Joback Calculated Property |
| Tboil | 987.08 | K | Joback Calculated Property |
| Tc | 1252.73 | K | Joback Calculated Property |
| Tfus | 768.20 | K | Joback Calculated Property |
| Vc | 0.647 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [481.45; 490.41] | J/mol×K | [987.08; 1252.73] | 
|
| Cp,gas | 484.51 | J/mol×K | 987.08 | Joback Calculated Property |
| Cp,gas | 488.03 | J/mol×K | 1031.36 | Joback Calculated Property |
| Cp,gas | 490.02 | J/mol×K | 1075.63 | Joback Calculated Property |
| Cp,gas | 490.41 | J/mol×K | 1119.91 | Joback Calculated Property |
| Cp,gas | 489.15 | J/mol×K | 1164.18 | Joback Calculated Property |
| Cp,gas | 486.18 | J/mol×K | 1208.46 | Joback Calculated Property |
| Cp,gas | 481.45 | J/mol×K | 1252.73 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Erythrityl tetranitrate.
Sources
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