4,5-Dichloro-1-nitroanthraquinone

4,5-dichloro-1-nitroanthracene-9,10-dione

CAS: 128-96-1

Molecular Formula	`C14H5Cl2NO4`
Molecular Weight	322.1 g/mol
LogP	4.0
Topological Polar Surface Area	80.0 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	4
Rotatable Bonds	0
Exact Mass	320.95956
Heavy Atoms	21
Complexity	492.0

Chemical Identifiers

CAS Number	128-96-1
SMILES	`C1=CC2=C(C(=C1)Cl)C(=O)C3=C(C=CC(=C3C2=O)[N+](=O)[O-])Cl`
InChIKey	`KBVOCALKCZCXKK-UHFFFAOYSA-N`

📖 Product Overview

4,5-Dichloro-1-nitroanthraquinone (CAS: 128-96-1) is a chemical compound with molecular formula C14H5Cl2NO4 and molecular weight 322.1 g/mol. Its IUPAC systematic name is 4,5-dichloro-1-nitroanthracene-9,10-dione. LogP 4.0 Topological Polar Surface Area 80.0 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 4 Rotatable Bonds 0 Exact Mass 320.95956 Heavy Atoms 21 Complexity 492.0 InChI Key: KBVOCALKCZCXKK-UHFFFAOYSA-N. SMILES: C1=CC2=C(C(=C1)Cl)C(=O)C3=C(C=CC(=C3C2=O)[N+](=O)[O-])Cl.

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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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