- Name
- irbesartan
- InChI
- InChI=1S/C25H28N6O/c1-2-3-10-22-26-25(15-6-7-16-25)24(32)31(22)17-18-11-13-19(14-12-18)20-8-4-5-9-21(20)23-27-29-30-28-23/h4-5,8-9,11-14H,2-3,6-7,10,15-17H2,1H3,(H,27,28,29,30)
- InChI Key
- YOSHYTLCDANDAN-UHFFFAOYSA-N
- Formula
- C25H28N6O
- SMILES
-
CCCCC1=NC2(CCCC2)C(=O)N1Cc1ccc
(-c2ccccc2-c2nn[nH]n2)cc1 - Mol. Weight (g/mol)
- 428.54
- 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
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Datasets
Mole fraction of irbesartan (1) [ref]
Operational condition: Pressure, kPa = 101 (Liquid)
| Temperature, K - Liquid | Mole fraction of irbesartan (1) - Liquid |
|---|---|
| 278.35 | 0.0003 |
| 283.15 | 0.0004 |
| 288.35 | 0.0004 |
| 293.60 | 0.0005 |
| 298.25 | 0.0007 |
| 302.95 | 0.0009 |
| 308.40 | 0.0010 |
| 312.75 | 0.0013 |
| 318.55 | 0.0016 |
| 323.10 | 0.0019 |