- Name
- Acetone
- InChI
- InChI=1S/C3H6O/c1-3(2)4/h1-2H3
- InChI Key
- CSCPPACGZOOCGX-UHFFFAOYSA-N
- Formula
- C3H6O
- SMILES
- CC(C)=O
- Mol. Weight (g/mol)
- 58.08
- CAS
- 67-64-1
- Name
- Water
- InChI
- InChI=1S/H2O/h1H2
- InChI Key
- XLYOFNOQVPJJNP-UHFFFAOYSA-N
- Formula
- H2O
- SMILES
- O
- Mol. Weight (g/mol)
- 18.02
- CAS
- 7732-18-5
- Name
- Cyclotetramethylenetetranitramine
- InChI
- InChI=1S/C4H8N8O8/c13-9(14)5-1-6(10(15)16)3-8(12(19)20)4-7(2-5)11(17)18/h1-4H2
- InChI Key
- UZGLIIJVICEWHF-UHFFFAOYSA-N
- Formula
- C4H8N8O8
- SMILES
-
O=[N+]([O-])N1CN([N+](=O)[O-])
CN([N+](=O)[O-])CN([N+](=O)[O- ])C1 - Mol. Weight (g/mol)
- 296.16
- CAS
- 2691-41-0
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Datasets
Mole fraction of Cyclotetramethylenetetranitramine (3) [ref]
Operational condition: Pressure, kPa = 100 (Liquid)
| Fixed | Measured | |
|---|---|---|
| Temperature, K - Liquid | Solvent: Mole fraction of Water (2) - Liquid | Mole fraction of Cyclotetramethylenetetranitramine (3) - Liquid |
| 293.15 | 0.0000 | 0.0045 |
| 293.15 | 0.1381 | 0.0042 |
| 293.15 | 0.2871 | 0.0028 |
| 293.15 | 0.4462 | 0.0016 |
| 293.15 | 0.5707 | 0.0007 |
| 293.15 | 0.6682 | 0.0003 |
| 293.15 | 0.7632 | 0.0001 |
| 293.15 | 0.8754 | 0.0000 |
| 298.15 | 0.0000 | 0.0048 |
| 298.15 | 0.1381 | 0.0045 |
| 298.15 | 0.2871 | 0.0031 |
| 298.15 | 0.4462 | 0.0018 |
| 298.15 | 0.5707 | 0.0009 |
| 298.15 | 0.6682 | 0.0004 |
| 298.15 | 0.7632 | 0.0001 |
| 298.15 | 0.8754 | 0.0000 |
Mole fraction of Cyclotetramethylenetetranitramine (3) [ref]
Operational condition: Pressure, kPa = 100 (Liquid)
| Fixed | Measured | |
|---|---|---|
| Temperature, K - Liquid | Solvent: Mole fraction of Water (2) - Liquid | Mole fraction of Cyclotetramethylenetetranitramine (3) - Liquid |
| 293.15 | 0.0000 | 0.0045 |
| 293.15 | 0.1381 | 0.0042 |
| 293.15 | 0.2871 | 0.0028 |
| 293.15 | 0.4462 | 0.0016 |
| 293.15 | 0.5707 | 0.0007 |
| 293.15 | 0.6682 | 0.0003 |
| 293.15 | 0.7632 | 0.0001 |
| 293.15 | 0.8754 | 0.0000 |
| 298.15 | 0.0000 | 0.0048 |
| 298.15 | 0.1381 | 0.0045 |
| 298.15 | 0.2871 | 0.0031 |
| 298.15 | 0.4462 | 0.0018 |
| 298.15 | 0.5707 | 0.0009 |
| 298.15 | 0.6682 | 0.0004 |
| 298.15 | 0.7632 | 0.0001 |
| 298.15 | 0.8754 | 0.0000 |