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Structure

1-(3-Benzo[b][1]benzazepin-11-ylpropyl)-4-piperidin-1-ium-1-ylpiperidin-1-ium-4-carboxamide dichloride

CAS
28027-99-8
Catalog Number
ACM28027998
Category
Other Products
Molecular Weight
517.534 g/mol
Molecular Formula
C28H38Cl2N4O

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Specification

Synonyms
1-(3-benzo[b][1]benzazepin-11-ylpropyl)-4-piperidin-1-ium-1-ylpiperidin-1-ium-4-carboxamide dichloride; Isonipecotamide,1-(3-(5H-dibenz(b,f)azepin-5-yl)propyl)-4-piperidino-,hydrochloride,hydrate (2:4:1);
IUPAC Name
1-(3-benzo[b][1]benzazepin-11-ylpropyl)-4-piperidin-1-ium-1-ylpiperidin-1-ium-4-carboxamide;dichloride
Canonical SMILES
C1CC[NH+](CC1)C2(CC[NH+](CC2)CCCN3C4=CC=CC=C4C=CC5=CC=CC=C53)C(=O)N.[Cl-].[Cl-]
InChI Key
QKCHGFSKOPWXKS-UHFFFAOYSA-N
Boiling Point
647.9ºC at 760 mmHg
Flash Point
345.6ºC
Exact Mass
516.24200
H-Bond Acceptor
4
H-Bond Donor
3
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