dimethyl-[2-[6-oxo-3-(trifluoromethyl)-11H-benzo[b][1,4]benzodiazepin-5-yl]ethyl]azanium chloride

CAS: 78110-20-0

Molecular Formula	`C18H19ClF3N3O`
Molecular Weight	385.8 g/mol
Topological Polar Surface Area	36.8 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	6
Rotatable Bonds	3
Exact Mass	385.11688
Heavy Atoms	26
Complexity	483.0

Chemical Identifiers

CAS Number	78110-20-0
SMILES	`C[NH+](C)CCN1C2=C(C=CC(=C2)C(F)(F)F)NC3=CC=CC=C3C1=O.[Cl-]`
InChIKey	`WQCCTIOYIIMUFS-UHFFFAOYSA-N`

📖 Product Overview

dimethyl-[2-[6-oxo-3-(trifluoromethyl)-11H-benzo[b][1,4]benzodiazepin-5-yl]ethyl]azanium chloride (CAS: 78110-20-0) is a chemical compound with molecular formula C18H19ClF3N3O and molecular weight 385.8 g/mol. Its IUPAC systematic name is dimethyl-[2-[6-oxo-3-(trifluoromethyl)-11H-benzo[b][1,4]benzodiazepin-5-yl]ethyl]azanium chloride. Topological Polar Surface Area 36.8 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 6 Rotatable Bonds 3 Exact Mass 385.11688 Heavy Atoms 26 Complexity 483.0 InChI Key: WQCCTIOYIIMUFS-UHFFFAOYSA-N. SMILES: C[NH+](C)CCN1C2=C(C=CC(=C2)C(F)(F)F)NC3=CC=CC=C3C1=O.[Cl-].

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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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📚 Academic Support

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Technical Blog Article

Multi-source research profile: chemical properties, regulatory status, and sourcing guide for dimethyl-[2-[6-oxo-3-(trifluoromethyl)-11H-benzo[b][1,4]benzodiazepin-5-yl]ethyl]azanium chloride.

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