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Structure

4-[1-(7-Benzyl-7,9-diazoniabicyclo[3.3.1]nonan-9-yl)propan-2-yl]morpholin-4-iumtrichloride trihydrate

CAS
23462-21-7
Catalog Number
ACM23462217
Category
Other Products
Molecular Weight
506.935 g/mol
Molecular Formula
C21H42Cl3N3O4

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Specification

IUPAC Name
4-[1-(3-benzyl-3,9-diazoniabicyclo[3.3.1]nonan-9-yl)propan-2-yl]morpholin-4-ium;trichloride;trihydrate
Canonical SMILES
CC(C[NH+]1C2CCCC1C[NH+](C2)CC3=CC=CC=C3)[NH+]4CCOCC4.O.O.O.[Cl-].[Cl-].[Cl-]
InChI Key
DQHBTODEMXBEPG-UHFFFAOYSA-N
Boiling Point
446.6ºC at 760mmHg
Flash Point
122.5ºC
Exact Mass
505.22400
H-Bond Acceptor
7
H-Bond Donor
6
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