AC1LCNSI
methyl 3-fluoro-3-[(2-phenyl-1H-indol-3-yl)sulfanyl]-2-(trifluoromethyl)prop-2-enoate
Also Known As: methyl 3-fluoro-3-[(2-phenyl-1H-indol-3-yl)sulfanyl]-2-(trifluoromethyl)prop-2-enoate
CAS: 4812-66-2
| Molecular Formula | C19H13F4NO2S |
|---|---|
| Molecular Weight | 395.0603 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 67.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 395.0603 |
| Monoisotopic Mass | 395.0603 |
| Heavy Atoms | 27 |
| Complexity | 575.0 |
Chemical Identifiers
| CAS Number | 4812-66-2 |
|---|---|
| SMILES | COC(=O)C(=C(F)SC1=C(NC2=CC=CC=C21)C3=CC=CC=C3)C(F)(F)F |
| InChIKey | BAUYQQFSOGHOLU-UHFFFAOYSA-N |
Product Overview
AC1LCNSI (CAS 4812-66-2), with molecular formula C19H13F4NO2S and molecular weight 395.0603 g/mol. IUPAC: methyl 3-fluoro-3-[(2-phenyl-1H-indol-3-yl)sulfanyl]-2-(trifluoromethyl)prop-2-enoate.
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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