- Name
- Benzoic acid, 3,5-dinitro-
- InChI
- InChI=1S/C7H4N2O6/c10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15/h1-3H,(H,10,11)
- InChI Key
- VYWYYJYRVSBHJQ-UHFFFAOYSA-N
- Formula
- C7H4N2O6
- SMILES
-
O=C(O)c1cc([N+](=O)[O-])cc([N+
](=O)[O-])c1 - Mol. Weight (g/mol)
- 212.12
- CAS
- 99-34-3
- Name
- Benzoic acid, 3-nitro-
- InChI
- InChI=1S/C7H5NO4/c9-7(10)5-2-1-3-6(4-5)8(11)12/h1-4H,(H,9,10)
- InChI Key
- AFPHTEQTJZKQAQ-UHFFFAOYSA-N
- Formula
- C7H5NO4
- SMILES
- O=C(O)c1cccc([N+](=O)[O-])c1
- Mol. Weight (g/mol)
- 167.12
- CAS
- 121-92-6
- 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
Datasets
Mass fraction of Benzoic acid, 3,5-dinitro- (1) [ref]
Operational condition: Pressure, kPa = 101.2 (Liquid)
| Fixed | Measured | |
|---|---|---|
| Temperature, K - Liquid | Mass fraction of Benzoic acid, 3-nitro- (2) - Liquid | Mass fraction of Benzoic acid, 3,5-dinitro- (1) - Liquid |
| 283.15 | 0.0000 | 0.2746 |
| 283.15 | 0.0611 | 0.2519 |
| 283.15 | 0.1348 | 0.2379 |
| 283.15 | 0.2106 | 0.2129 |
| 283.15 | 0.2617 | 0.1922 |
| 283.15 | 0.2750 | 0.1784 |
| 298.15 | 0.0000 | 0.3152 |
| 298.15 | 0.0934 | 0.2797 |
| 298.15 | 0.1801 | 0.2581 |
| 298.15 | 0.2631 | 0.2351 |
| 298.15 | 0.3135 | 0.2186 |
| 298.15 | 0.3468 | 0.1953 |
| 313.15 | 0.0000 | 0.3640 |
| 313.15 | 0.1098 | 0.3239 |
| 313.15 | 0.2125 | 0.2827 |
| 313.15 | 0.3117 | 0.2454 |
| 313.15 | 0.3913 | 0.2216 |
| 313.15 | 0.4142 | 0.2028 |
Mass fraction of Benzoic acid, 3-nitro- (2) [ref]
Operational condition: Pressure, kPa = 101.2 (Liquid)
| Fixed | Measured | |
|---|---|---|
| Temperature, K - Liquid | Mass fraction of Benzoic acid, 3,5-dinitro- (1) - Liquid | Mass fraction of Benzoic acid, 3-nitro- (2) - Liquid |
| 283.15 | 0.1784 | 0.2750 |
| 283.15 | 0.1457 | 0.2873 |
| 283.15 | 0.1092 | 0.3021 |
| 283.15 | 0.0602 | 0.3206 |
| 283.15 | 0.0273 | 0.3317 |
| 298.15 | 0.1953 | 0.3468 |
| 298.15 | 0.1373 | 0.3694 |
| 298.15 | 0.1054 | 0.3795 |
| 298.15 | 0.0738 | 0.3985 |
| 298.15 | 0.0272 | 0.4191 |
| 313.15 | 0.2028 | 0.4142 |
| 313.15 | 0.1666 | 0.4207 |
| 313.15 | 0.1250 | 0.4428 |
| 313.15 | 0.0861 | 0.4636 |
| 313.15 | 0.0445 | 0.4871 |
Mass fraction of Benzoic acid, 3-nitro- (2) [ref]
Operational condition: Pressure, kPa = 101.2 (Liquid)
| Temperature, K - Liquid | Mass fraction of Benzoic acid, 3-nitro- (2) - Liquid |
|---|---|
| 283.15 | 0.2750 |
| 298.15 | 0.3468 |
| 313.15 | 0.4142 |
Mass fraction of Benzoic acid, 3,5-dinitro- (1) [ref]
Operational condition: Pressure, kPa = 101.2 (Liquid)
| Temperature, K - Liquid | Mass fraction of Benzoic acid, 3,5-dinitro- (1) - Liquid |
|---|---|
| 283.15 | 0.1784 |
| 298.15 | 0.1953 |
| 313.15 | 0.2028 |
Mass fraction of Benzoic acid, 3,5-dinitro- (1) [ref]
Operational condition: Pressure, kPa = 101.2 (Liquid)
| Fixed | Measured | |
|---|---|---|
| Temperature, K - Liquid | Mass fraction of Benzoic acid, 3-nitro- (2) - Liquid | Mass fraction of Benzoic acid, 3,5-dinitro- (1) - Liquid |
| 283.15 | 0.0000 | 0.2746 |
| 283.15 | 0.0611 | 0.2519 |
| 283.15 | 0.1348 | 0.2379 |
| 283.15 | 0.2106 | 0.2129 |
| 283.15 | 0.2617 | 0.1922 |
| 283.15 | 0.2750 | 0.1784 |
| 298.15 | 0.0000 | 0.3152 |
| 298.15 | 0.0934 | 0.2797 |
| 298.15 | 0.1801 | 0.2581 |
| 298.15 | 0.2631 | 0.2351 |
| 298.15 | 0.3135 | 0.2186 |
| 298.15 | 0.3468 | 0.1953 |
| 313.15 | 0.0000 | 0.3640 |
| 313.15 | 0.1098 | 0.3239 |
| 313.15 | 0.2125 | 0.2827 |
| 313.15 | 0.3117 | 0.2454 |
| 313.15 | 0.3913 | 0.2216 |
| 313.15 | 0.4142 | 0.2028 |
Mass fraction of Benzoic acid, 3-nitro- (2) [ref]
Operational condition: Pressure, kPa = 101.2 (Liquid)
| Fixed | Measured | |
|---|---|---|
| Temperature, K - Liquid | Mass fraction of Benzoic acid, 3,5-dinitro- (1) - Liquid | Mass fraction of Benzoic acid, 3-nitro- (2) - Liquid |
| 283.15 | 0.1784 | 0.2750 |
| 283.15 | 0.1457 | 0.2873 |
| 283.15 | 0.1092 | 0.3021 |
| 283.15 | 0.0602 | 0.3206 |
| 283.15 | 0.0273 | 0.3317 |
| 298.15 | 0.1953 | 0.3468 |
| 298.15 | 0.1373 | 0.3694 |
| 298.15 | 0.1054 | 0.3795 |
| 298.15 | 0.0738 | 0.3985 |
| 298.15 | 0.0272 | 0.4191 |
| 313.15 | 0.2028 | 0.4142 |
| 313.15 | 0.1666 | 0.4207 |
| 313.15 | 0.1250 | 0.4428 |
| 313.15 | 0.0861 | 0.4636 |
| 313.15 | 0.0445 | 0.4871 |
Mass fraction of Benzoic acid, 3-nitro- (2) [ref]
Operational condition: Pressure, kPa = 101.2 (Liquid)
| Temperature, K - Liquid | Mass fraction of Benzoic acid, 3-nitro- (2) - Liquid |
|---|---|
| 283.15 | 0.2750 |
| 298.15 | 0.3468 |
| 313.15 | 0.4142 |
Mass fraction of Benzoic acid, 3,5-dinitro- (1) [ref]
Operational condition: Pressure, kPa = 101.2 (Liquid)
| Temperature, K - Liquid | Mass fraction of Benzoic acid, 3,5-dinitro- (1) - Liquid |
|---|---|
| 283.15 | 0.1784 |
| 298.15 | 0.1953 |
| 313.15 | 0.2028 |