- InChI
- InChI=1S/C8H16N2O6/c11-9(12)15-7-5-3-1-2-4-6-8-16-10(13)14/h1-8H2
- InChI Key
- DCPXXVXZJCAQDR-UHFFFAOYSA-N
- Formula
- C8H16N2O6
- SMILES
-
O=[N+]([O-])OCCCCCCCCO[N+](=O)
[O-] - Molecular Weight1
- 236.22
- Other Names
-
- 8-nitrooxyoctyl nitrate
- 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).
- Inp : Non-polar retention indices.
- 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° | -122.42 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -494.41 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 41.57 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 71.40 | kJ/mol | Joback Calculated Property |
| log10WS | -4.14 | Aq. Sol... | |
| logPoct/wat | 1.744 | Crippen Calculated Property | |
| McVol | 170.160 | ml/mol | McGowan Calculated Property |
| Pc | 2510.03 | kPa | Joback Calculated Property |
| Inp | 1647.00 | NIST | |
| Tboil | 730.96 | K | Joback Calculated Property |
| Tc | 946.13 | K | Joback Calculated Property |
| Tfus | 511.60 | K | Joback Calculated Property |
| Vc | 0.683 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [489.26; 550.63] | J/mol×K | [730.96; 946.13] | 
|
| Cp,gas | 489.26 | J/mol×K | 730.96 | Joback Calculated Property |
| Cp,gas | 501.49 | J/mol×K | 766.82 | Joback Calculated Property |
| Cp,gas | 512.92 | J/mol×K | 802.68 | Joback Calculated Property |
| Cp,gas | 523.54 | J/mol×K | 838.54 | Joback Calculated Property |
| Cp,gas | 533.37 | J/mol×K | 874.41 | Joback Calculated Property |
| Cp,gas | 542.39 | J/mol×K | 910.27 | Joback Calculated Property |
| Cp,gas | 550.63 | J/mol×K | 946.13 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,8-Octanediol, dinitrate.
Sources
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