AC1L8X1B
1-[(2,5-dibromothiophen-3-yl)methyl]-6-methoxy-7-phenylmethoxy-3,4-dihydroisoquinoline
Also Known As: 1-[(2,5-dibromothiophen-3-yl)methyl]-6-methoxy-7-phenylmethoxy-3,4-dihydroisoquinoline
CAS: 77014-14-3
| Molecular Formula | C22H19Br2NO2S |
|---|---|
| Molecular Weight | 518.9503 g/mol |
| LogP | 6.4 |
| Topological Polar Surface Area | 59.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 518.9503 |
| Monoisotopic Mass | 518.9503 |
| Heavy Atoms | 28 |
| Complexity | 543.0 |
Chemical Identifiers
| CAS Number | 77014-14-3 |
|---|---|
| SMILES | COC1=C(C=C2C(=C1)CCN=C2CC3=C(SC(=C3)Br)Br)OCC4=CC=CC=C4 |
| InChIKey | SWHQTRKUZJJJOT-UHFFFAOYSA-N |
Product Overview
AC1L8X1B (CAS 77014-14-3), with molecular formula C22H19Br2NO2S and molecular weight 518.9503 g/mol. IUPAC: 1-[(2,5-dibromothiophen-3-yl)methyl]-6-methoxy-7-phenylmethoxy-3,4-dihydroisoquinoline.
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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