Mls002608530
2-(2-methyl-1H-indol-3-yl)cyclohexa-2,5-diene-1,4-dione
Also Known As: 2-(2-methyl-1H-indol-3-yl)cyclohexa-2,5-diene-1,4-dione|2-(2-methyl-1H-indol-3-yl)-p-benzoquinone|J2.604.159G|2-(2-Methyl-1H-indole-3-yl)-1,4-benzoquinone|2,5-Cyclohexadiene-1,4-dione,2-(2-methyl-1H-indol-3-yl)-
CAS: 80641-49-2
| Molecular Formula | C15H11NO2 |
|---|---|
| Molecular Weight | 237.07898 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 49.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 237.07898 |
| Monoisotopic Mass | 237.07898 |
| Heavy Atoms | 18 |
| Complexity | 449.0 |
Chemical Identifiers
| CAS Number | 80641-49-2 |
|---|---|
| SMILES | CC1=C(C2=CC=CC=C2N1)C3=CC(=O)C=CC3=O |
| InChIKey | SYIXSZIGHISTNJ-UHFFFAOYSA-N |
Product Overview
Mls002608530 (CAS 80641-49-2), with molecular formula C15H11NO2 and molecular weight 237.07898 g/mol. IUPAC: 2-(2-methyl-1H-indol-3-yl)cyclohexa-2,5-diene-1,4-dione.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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