AC1L6MPD structure

AC1L6MPD

5,5-dibromo-1-(4-methylphenyl)sulfonyl-3,4-dihydro-2H-1-benzazocin-6-one

Also Known As: 5,5-Dibromo-1-(4-methylbenzene-1-sulfonyl)-2,3,4,5-tetrahydro-1-benzazocin-6(1H)-one|5,5-dibromo-1-(4-methylphenyl)sulfonyl-3,4-dihydro-2H-1-benz|5,5-dibromo-1-(4-methylphenyl)sulfonyl-3,4-dihydro-2H-1-benzazocin-6-one

CAS: 36036-87-0
Molecular Formula C18H17Br2NO3S
Molecular Weight 484.9296 g/mol
LogP 4.8
Topological Polar Surface Area 62.8 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 4
Rotatable Bonds 2
Exact Mass 484.9296
Monoisotopic Mass 484.9296
Heavy Atoms 25
Complexity 594.0

Chemical Identifiers

CAS Number 36036-87-0
SMILES CC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C(=O)C3=CC=CC=C32)(Br)Br
InChIKey VLKGRULXQJUGJJ-UHFFFAOYSA-N

Product Overview

AC1L6MPD (CAS 36036-87-0), with molecular formula C18H17Br2NO3S and molecular weight 484.9296 g/mol. IUPAC: 5,5-dibromo-1-(4-methylphenyl)sulfonyl-3,4-dihydro-2H-1-benzazocin-6-one.

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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.
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