(4-methoxy-6,11-dihydrobenzo[c][1]benzothiepin-11-yl)methyl-methylazanium chloride

CAS: 82394-10-3

Molecular Formula	`C17H20ClNOS`
Molecular Weight	321.9 g/mol
Topological Polar Surface Area	51.1 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	3
Rotatable Bonds	3
Exact Mass	321.0954
Heavy Atoms	21
Complexity	311.0

Chemical Identifiers

CAS Number	82394-10-3
SMILES	`C[NH2+]CC1C2=C(C(=CC=C2)OC)SCC3=CC=CC=C13.[Cl-]`
InChIKey	`NMQXJIAJDPUOSU-UHFFFAOYSA-N`

📖 Product Overview

(4-methoxy-6,11-dihydrobenzo[c][1]benzothiepin-11-yl)methyl-methylazanium chloride (CAS: 82394-10-3) is a chemical compound with molecular formula C17H20ClNOS and molecular weight 321.9 g/mol. Its IUPAC systematic name is (4-methoxy-6,11-dihydrobenzo[c][1]benzothiepin-11-yl)methyl-methylazanium chloride. Topological Polar Surface Area 51.1 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 3 Rotatable Bonds 3 Exact Mass 321.0954 Heavy Atoms 21 Complexity 311.0 InChI Key: NMQXJIAJDPUOSU-UHFFFAOYSA-N. SMILES: C[NH2+]CC1C2=C(C(=CC=C2)OC)SCC3=CC=CC=C13.[Cl-].

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📚 Academic Support

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