H.C. 9013

benzyl-[3-[[[3-[benzyl(diethyl)azaniumyl]propylamino]-(4-nitrophenoxy)phosphoryl]amino]propyl]-diethylazanium dibromide

CAS: 19143-09-0

Molecular Formula	`C34H52Br2N5O4P`
Molecular Weight	785.6 g/mol
Topological Polar Surface Area	96.2 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	8
Rotatable Bonds	20
Exact Mass	785.2103
Heavy Atoms	46
Complexity	795.0

Chemical Identifiers

CAS Number	19143-09-0
SMILES	`CC[N+](CC)(CCCNP(=O)(NCCC[N+](CC)(CC)CC1=CC=CC=C1)OC2=CC=C(C=C2)[N+](=O)[O-])CC3=CC=CC=C3.[Br-].[Br-]`
InChIKey	`IIBSXRUONXELFM-UHFFFAOYSA-L`

📖 Product Overview

H.C. 9013 (CAS: 19143-09-0) is a chemical compound with molecular formula C34H52Br2N5O4P and molecular weight 785.6 g/mol. Its IUPAC systematic name is benzyl-[3-[[[3-[benzyl(diethyl)azaniumyl]propylamino]-(4-nitrophenoxy)phosphoryl]amino]propyl]-diethylazanium dibromide. Topological Polar Surface Area 96.2 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 8 Rotatable Bonds 20 Exact Mass 785.2103 Heavy Atoms 46 Complexity 795.0 InChI Key: IIBSXRUONXELFM-UHFFFAOYSA-L. SMILES: CC[N+](CC)(CCCNP(=O)(NCCC[N+](CC)(CC)CC1=CC=CC=C1)OC2=CC=C(C=C2)[N+](=O)[O-])CC3=CC=CC=C3.[Br-].[Br-].

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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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