diethylaminomethyl 3-(3,5-dioxo-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl)benzoate

CAS: 69844-12-8

Molecular Formula	`C21H24N2O4`
Molecular Weight	368.4 g/mol
LogP	2.5
Topological Polar Surface Area	66.9 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	5
Rotatable Bonds	7
Exact Mass	368.1736
Heavy Atoms	27
Complexity	627.0

Chemical Identifiers

CAS Number	69844-12-8
SMILES	`CCN(CC)COC(=O)C1=CC(=CC=C1)N2C(=O)C3C4CC(C3C2=O)C=C4`
InChIKey	`ACVUVCRIUUCMBP-UHFFFAOYSA-N`

📖 Product Overview

diethylaminomethyl 3-(3,5-dioxo-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl)benzoate (CAS: 69844-12-8) is a chemical compound with molecular formula C21H24N2O4 and molecular weight 368.4 g/mol. Its IUPAC systematic name is diethylaminomethyl 3-(3,5-dioxo-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl)benzoate. LogP 2.5 Topological Polar Surface Area 66.9 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 5 Rotatable Bonds 7 Exact Mass 368.1736 Heavy Atoms 27 Complexity 627.0 InChI Key: ACVUVCRIUUCMBP-UHFFFAOYSA-N. SMILES: CCN(CC)COC(=O)C1=CC(=CC=C1)N2C(=O)C3C4CC(C3C2=O)C=C4.

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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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Technical Blog Article

Multi-source research profile: chemical properties, regulatory status, and sourcing guide for diethylaminomethyl 3-(3,5-dioxo-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl)benzoate.

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