N-(4-bromo-9,10-dioxoanthracen-1-yl)benzamide

CAS: 81-44-7

Molecular Formula	`C21H12BrNO3`
Molecular Weight	406.2 g/mol
LogP	4.9
Topological Polar Surface Area	63.2 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	3
Rotatable Bonds	2
Exact Mass	405.00006
Heavy Atoms	26
Complexity	586.0

Chemical Identifiers

CAS Number	81-44-7
SMILES	`C1=CC=C(C=C1)C(=O)NC2=C3C(=C(C=C2)Br)C(=O)C4=CC=CC=C4C3=O`
InChIKey	`JKRCBOYQTINLRS-UHFFFAOYSA-N`

📖 Product Overview

N-(4-bromo-9,10-dioxoanthracen-1-yl)benzamide (CAS: 81-44-7) is a chemical compound with molecular formula C21H12BrNO3 and molecular weight 406.2 g/mol. Its IUPAC systematic name is N-(4-bromo-9,10-dioxoanthracen-1-yl)benzamide. LogP 4.9 Topological Polar Surface Area 63.2 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 3 Rotatable Bonds 2 Exact Mass 405.00006 Heavy Atoms 26 Complexity 586.0 InChI Key: JKRCBOYQTINLRS-UHFFFAOYSA-N. SMILES: C1=CC=C(C=C1)C(=O)NC2=C3C(=C(C=C2)Br)C(=O)C4=CC=CC=C4C3=O.

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