Ro 2-1996

[4-[[4-(dimethylamino)-2-(dimethylcarbamoyloxy)phenyl]diazenyl]phenyl]-trimethylazanium iodide

CAS: 72066-27-4

Molecular Formula	`C20H28IN5O2`
Molecular Weight	497.4 g/mol
Topological Polar Surface Area	57.5 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	6
Rotatable Bonds	6
Exact Mass	497.12878
Heavy Atoms	28
Complexity	507.0

Chemical Identifiers

CAS Number	72066-27-4
SMILES	`CN(C)C1=CC(=C(C=C1)N=NC2=CC=C(C=C2)[N+](C)(C)C)OC(=O)N(C)C.[I-]`
InChIKey	`IEMPLLSEVZGIGI-UHFFFAOYSA-M`

📖 Product Overview

Ro 2-1996 (CAS: 72066-27-4) is a chemical compound with molecular formula C20H28IN5O2 and molecular weight 497.4 g/mol. Its IUPAC systematic name is [4-[[4-(dimethylamino)-2-(dimethylcarbamoyloxy)phenyl]diazenyl]phenyl]-trimethylazanium iodide. Topological Polar Surface Area 57.5 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 6 Rotatable Bonds 6 Exact Mass 497.12878 Heavy Atoms 28 Complexity 507.0 InChI Key: IEMPLLSEVZGIGI-UHFFFAOYSA-M. SMILES: CN(C)C1=CC(=C(C=C1)N=NC2=CC=C(C=C2)[N+](C)(C)C)OC(=O)N(C)C.[I-].

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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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