5H-Cyclohepta(b)naphthalen-6,9-imin-5-one, 5a,6,7,8,9,10,10a,11-octahydro-12-methyl-, hydrochloride, (5aR-(5a-alpha,6-alpha,9-alpha,10a-alpha))-

(1R,2R,11R,13S)-16-methyl-16-azoniatetracyclo[11.2.1.02,11.04,9]hexadeca-4,6,8-trien-3-one chloride

CAS: 57495-73-5

Molecular Formula	`C16H20ClNO`
Molecular Weight	277.79 g/mol
Topological Polar Surface Area	21.5 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	2
Rotatable Bonds	0
Exact Mass	277.12335
Heavy Atoms	19
Complexity	366.0

Chemical Identifiers

CAS Number	57495-73-5
SMILES	`C[NH+]1C2CCC1C3C(C2)CC4=CC=CC=C4C3=O.[Cl-]`
InChIKey	`MGDXTPDCVRWLGB-DHGOQAQZSA-N`

📖 Product Overview

5H-Cyclohepta(b)naphthalen-6,9-imin-5-one, 5a,6,7,8,9,10,10a,11-octahydro-12-methyl-, hydrochloride, (5aR-(5a-alpha,6-alpha,9-alpha,10a-alpha))- (CAS: 57495-73-5) is a chemical compound with molecular formula C16H20ClNO and molecular weight 277.79 g/mol. Its IUPAC systematic name is (1R,2R,11R,13S)-16-methyl-16-azoniatetracyclo[11.2.1.02,11.04,9]hexadeca-4,6,8-trien-3-one chloride. Topological Polar Surface Area 21.5 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 2 Rotatable Bonds 0 Exact Mass 277.12335 Heavy Atoms 19 Complexity 366.0 InChI Key: MGDXTPDCVRWLGB-DHGOQAQZSA-N. SMILES: C[NH+]1C2CCC1C3C(C2)CC4=CC=CC=C4C3=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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Technical Blog Article

Multi-source research profile: chemical properties, regulatory status, and sourcing guide for 5H-Cyclohepta(b)naphthalen-6,9-imin-5-one, 5a,6,7,8,9,10,10a,11-octahydro-12-methyl-, hydrochloride, (5aR-(5a-alpha,6-alpha,9-alpha,10a-alpha))-.

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