9,10-Anthracenedione, 1,1'-[(6-phenoxy-1,3,5-triazine-2,4-diyl)diimino]bis-

1-[[4-[(9,10-dioxoanthracen-1-yl)amino]-6-phenoxy-1,3,5-triazin-2-yl]amino]anthracene-9,10-dione

CAS: 1965-81-7

Molecular Formula	`C37H21N5O5`
Molecular Weight	615.6 g/mol
LogP	8.6
Topological Polar Surface Area	140.0 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	10
Rotatable Bonds	6
Exact Mass	615.1543
Heavy Atoms	47
Complexity	1130.0

Chemical Identifiers

CAS Number	1965-81-7
SMILES	`C1=CC=C(C=C1)OC2=NC(=NC(=N2)NC3=CC=CC4=C3C(=O)C5=CC=CC=C5C4=O)NC6=CC=CC7=C6C(=O)C8=CC=CC=C8C7=O`
InChIKey	`IBVZVLHYMNSMOT-UHFFFAOYSA-N`

📖 Product Overview

9,10-Anthracenedione, 1,1'-[(6-phenoxy-1,3,5-triazine-2,4-diyl)diimino]bis- (CAS: 1965-81-7) is a chemical compound with molecular formula C37H21N5O5 and molecular weight 615.6 g/mol. Its IUPAC systematic name is 1-[[4-[(9,10-dioxoanthracen-1-yl)amino]-6-phenoxy-1,3,5-triazin-2-yl]amino]anthracene-9,10-dione. LogP 8.6 Topological Polar Surface Area 140.0 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 10 Rotatable Bonds 6 Exact Mass 615.1543 Heavy Atoms 47 Complexity 1130.0 InChI Key: IBVZVLHYMNSMOT-UHFFFAOYSA-N. SMILES: C1=CC=C(C=C1)OC2=NC(=NC(=N2)NC3=CC=CC4=C3C(=O)C5=CC=CC=C5C4=O)NC6=CC=CC7=C6C(=O)C8=CC=CC=C8C7=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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