- InChI
- InChI=1S/C10H4N4O8/c15-11(16)6-1-5-2-7(12(17)18)4-9(14(21)22)10(5)8(3-6)13(19)20/h1-4H
- InChI Key
- BFMBQYIQQLBGJA-UHFFFAOYSA-N
- Formula
- C10H4N4O8
- SMILES
-
O=[N+]([O-])c1cc([N+](=O)[O-])
c2c([N+](=O)[O-])cc([N+](=O)[O -])cc2c1 - Molecular Weight1
- 308.16
- CAS
- 28995-89-3
- Other Names
-
- 1,3,6,8-Tetranitronaphthalene
- 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° | 356.06 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 88.95 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 56.60 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 110.78 | kJ/mol | Joback Calculated Property |
| log10WS | -5.88 | Crippen Calculated Property | |
| logPoct/wat | 2.473 | Crippen Calculated Property | |
| McVol | 178.220 | ml/mol | McGowan Calculated Property |
| Pc | 3838.78 | kPa | Joback Calculated Property |
| Inp | [442.85; 442.85] |
|
|
| Inp | 442.85 | NIST | |
| Inp | 442.85 | NIST | |
| Tboil | 1101.14 | K | Joback Calculated Property |
| Tc | 1409.82 | K | Joback Calculated Property |
| Tfus | 886.10 | K | Joback Calculated Property |
| Vc | 0.738 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [512.06; 546.23] | J/mol×K | [1101.14; 1409.82] |
|
| Cp,gas | 512.06 | J/mol×K | 1101.14 | Joback Calculated Property |
| Cp,gas | 518.05 | J/mol×K | 1152.59 | Joback Calculated Property |
| Cp,gas | 523.72 | J/mol×K | 1204.03 | Joback Calculated Property |
| Cp,gas | 529.21 | J/mol×K | 1255.48 | Joback Calculated Property |
| Cp,gas | 534.69 | J/mol×K | 1306.93 | Joback Calculated Property |
| Cp,gas | 540.30 | J/mol×K | 1358.38 | Joback Calculated Property |
| Cp,gas | 546.23 | J/mol×K | 1409.82 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Naphthalene, 1,3,6,8-tetranitro-.
Sources
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