Ammonium, bis(3-hydroxypropyl)dimethyl-, 2,4,6-trinitrobenzenesulfonate, dimethanesulfonate, (ester)

dimethyl-bis(3-methylsulfonyloxypropyl)azanium;2,4,6-trinitrobenzenesulfonate

CAS: 3506-06-7

Molecular Formula	`C16H26N4O15S3`
Molecular Weight	610.6 g/mol
Topological Polar Surface Area	307.0 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	15
Rotatable Bonds	10
Exact Mass	610.05566
Heavy Atoms	38
Complexity	858.0

Chemical Identifiers

CAS Number	3506-06-7
SMILES	`C[N+](C)(CCCOS(=O)(=O)C)CCCOS(=O)(=O)C.C1=C(C=C(C(=C1[N+](=O)[O-])S(=O)(=O)[O-])[N+](=O)[O-])[N+](=O)[O-]`
InChIKey	`BRHSXGAOTZRFSP-UHFFFAOYSA-M`

📖 Product Overview

Ammonium, bis(3-hydroxypropyl)dimethyl-, 2,4,6-trinitrobenzenesulfonate, dimethanesulfonate, (ester) (CAS: 3506-06-7) is a chemical compound with molecular formula C16H26N4O15S3 and molecular weight 610.6 g/mol. Its IUPAC systematic name is dimethyl-bis(3-methylsulfonyloxypropyl)azanium;2,4,6-trinitrobenzenesulfonate. Topological Polar Surface Area 307.0 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 15 Rotatable Bonds 10 Exact Mass 610.05566 Heavy Atoms 38 Complexity 858.0 InChI Key: BRHSXGAOTZRFSP-UHFFFAOYSA-M. SMILES: C[N+](C)(CCCOS(=O)(=O)C)CCCOS(=O)(=O)C.C1=C(C=C(C(=C1[N+](=O)[O-])S(=O)(=O)[O-])[N+](=O)[O-])[N+](=O)[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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