10-(2-Dimethylaminoethyl)-10,11-dihydrodibenzo(b,f)thiepin-10-carbonitrile hydrogen oxalate

2-(5-cyano-6H-benzo[b][1]benzothiepin-5-yl)ethyl-dimethylazanium;2-hydroxy-2-oxoacetate

CAS: 87033-55-4

Molecular Formula	`C21H22N2O4S`
Molecular Weight	398.5 g/mol

Chemical Identifiers

CAS Number	87033-55-4
SMILES	`C[NH+](C)CCC1(CC2=CC=CC=C2SC3=CC=CC=C31)C#N.C(=O)(C(=O)[O-])O`
InChIKey	`VXUIKAAVZJSEDO-UHFFFAOYSA-N`

📖 Product Overview

10-(2-Dimethylaminoethyl)-10,11-dihydrodibenzo(b,f)thiepin-10-carbonitrile hydrogen oxalate (CAS: 87033-55-4) is a chemical compound with molecular formula C21H22N2O4S and molecular weight 398.5 g/mol. Its IUPAC systematic name is 2-(5-cyano-6H-benzo[b][1]benzothiepin-5-yl)ethyl-dimethylazanium;2-hydroxy-2-oxoacetate. InChI Key: VXUIKAAVZJSEDO-UHFFFAOYSA-N. SMILES: C[NH+](C)CCC1(CC2=CC=CC=C2SC3=CC=CC=C31)C#N.C(=O)(C(=O)[O-])O.

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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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