doxepin

3-(6H-benzo[c][1]benzoxepin-11-ylidene)-N,N-dimethylpropan-1-amine

CAS: 1668-19-5

Molecular Formula	`C19H21NO`
Molecular Weight	279.4 g/mol
LogP	4.3
Topological Polar Surface Area	12.5 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	2
Rotatable Bonds	3
Exact Mass	279.16232
Heavy Atoms	21
Complexity	363.0

Chemical Identifiers

CAS Number	1668-19-5
SMILES	`CN(C)CCC=C1C2=CC=CC=C2COC3=CC=CC=C31`
InChIKey	`ODQWQRRAPPTVAG-UHFFFAOYSA-N`

📖 Product Overview

doxepin (CAS: 1668-19-5) is a chemical compound with molecular formula C19H21NO and molecular weight 279.4 g/mol. Its IUPAC systematic name is 3-(6H-benzo[c][1]benzoxepin-11-ylidene)-N,N-dimethylpropan-1-amine. LogP 4.3 Topological Polar Surface Area 12.5 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 2 Rotatable Bonds 3 Exact Mass 279.16232 Heavy Atoms 21 Complexity 363.0 InChI Key: ODQWQRRAPPTVAG-UHFFFAOYSA-N. SMILES: CN(C)CCC=C1C2=CC=CC=C2COC3=CC=CC=C31.

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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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What documentation do you provide with the product?

We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.

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