- Name
- Acetonitrile
- InChI
- InChI=1S/C2H3N/c1-2-3/h1H3
- InChI Key
- WEVYAHXRMPXWCK-UHFFFAOYSA-N
- Formula
- C2H3N
- SMILES
- CC#N
- Mol. Weight (g/mol)
- 41.05
- CAS
- 75-05-8
- Name
- 1-Butanol, 3-methyl-
- InChI
- InChI=1S/C5H12O/c1-5(2)3-4-6/h5-6H,3-4H2,1-2H3
- InChI Key
- PHTQWCKDNZKARW-UHFFFAOYSA-N
- Formula
- C5H12O
- SMILES
- CC(C)CCO
- Mol. Weight (g/mol)
- 88.15
- CAS
- 123-51-3
- Name
- Pyrene
- InChI
- InChI=1S/C16H10/c1-3-11-7-9-13-5-2-6-14-10-8-12(4-1)15(11)16(13)14/h1-10H
- InChI Key
- BBEAQIROQSPTKN-UHFFFAOYSA-N
- Formula
- C16H10
- SMILES
- c1cc2ccc3cccc4ccc(c1)c2c34
- Mol. Weight (g/mol)
- 202.25
- CAS
- 129-00-0
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Datasets
Mole fraction of Pyrene (3) [ref]
Operational conditions:
- Temperature, K = 299.2 (Liquid)
- Pressure, kPa = 101 (Liquid)
| Solvent: Mole fraction of Acetonitrile (1) - Liquid | Mole fraction of Pyrene (3) - Liquid |
|---|---|
| 0.0000 | 0.0055 |
| 0.1981 | 0.0100 |
| 0.3709 | 0.0122 |
| 0.5829 | 0.0130 |
| 0.6600 | 0.0126 |
| 0.7605 | 0.0113 |
| 0.8929 | 0.0085 |
| 0.9461 | 0.0073 |
| 1.0000 | 0.0061 |
Mole fraction of Pyrene (3) [ref]
Operational conditions:
- Temperature, K = 299.2 (Liquid)
- Pressure, kPa = 101 (Liquid)
| Solvent: Mole fraction of Acetonitrile (1) - Liquid | Mole fraction of Pyrene (3) - Liquid |
|---|---|
| 0.0000 | 0.0055 |
| 0.1981 | 0.0100 |
| 0.3709 | 0.0122 |
| 0.5829 | 0.0130 |
| 0.6600 | 0.0126 |
| 0.7605 | 0.0113 |
| 0.8929 | 0.0085 |
| 0.9461 | 0.0073 |
| 1.0000 | 0.0061 |