- InChI
- InChI=1S/C6H10N4O13/c11-7(12)20-3-5(22-9(15)16)1-19-2-6(23-10(17)18)4-21-8(13)14/h5-6H,1-4H2
- InChI Key
- SKKBQEZMHMDRLE-UHFFFAOYSA-N
- Formula
- C6H10N4O13
- SMILES
-
O=[N+]([O-])OCC(COCC(CO[N+](=O
)[O-])O[N+](=O)[O-])O[N+](=O)[ O-] - Molecular Weight1
- 346.16
- CAS
- 20600-96-8
- Other Names
-
- Diglycerol tetranitrate
- Tetranitro diglycerin
- 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 | -3161.90 | kJ/mol | NIST |
| ΔfG° | -388.04 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -881.87 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 55.63 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 106.59 | kJ/mol | Joback Calculated Property |
| log10WS | -2.29 | Crippen Calculated Property | |
| logPoct/wat | -1.427 | Crippen Calculated Property | |
| McVol | 194.430 | ml/mol | McGowan Calculated Property |
| Pc | 3035.62 | kPa | Joback Calculated Property |
| Tboil | 1055.26 | K | Joback Calculated Property |
| Tc | 1313.31 | K | Joback Calculated Property |
| Tfus | 812.97 | K | Joback Calculated Property |
| Vc | 0.777 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [595.81; 615.19] | J/mol×K | [1055.26; 1313.31] | 
|
| Cp,gas | 612.81 | J/mol×K | 1055.26 | Joback Calculated Property |
| Cp,gas | 614.95 | J/mol×K | 1098.27 | Joback Calculated Property |
| Cp,gas | 615.19 | J/mol×K | 1141.28 | Joback Calculated Property |
| Cp,gas | 613.46 | J/mol×K | 1184.28 | Joback Calculated Property |
| Cp,gas | 609.69 | J/mol×K | 1227.29 | Joback Calculated Property |
| Cp,gas | 603.83 | J/mol×K | 1270.30 | Joback Calculated Property |
| Cp,gas | 595.81 | J/mol×K | 1313.31 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,2-Propanediol, 3,3'-oxydi-, tetranitrate.
Sources
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