Thonzonium Bromide
Basic information
- CAS
553-08-2- Standard SMILES
CCCCCCCCCCCCCCCC[N+](C)(C)CCN(Cc1ccc(OC)cc1)c1ncccn1.[Br-]- InChIKey
WBWDWFZTSDZAIG-UHFFFAOYSA-M- Molecular formula
- C32H55N4O.Br
- Average molar mass
- 591.7 g/mol
- Monoisotopic mass
- 590.35592
Overview
Thonzonium Bromide is a cationic surface-active compound. As an additive to pharmacologic formulations, thonzonium bromide causes dispersion and penetration of cellular debris and exudate, thereby promoting tissue contact of the administered medication.
Names & identifiers
- Preferred name
- Thonzonium Bromide
- IUPAC
- hexadecyl-[2-[(4-methoxyphenyl)methyl-pyrimidin-2-ylamino]ethyl]-dimethylazanium bromide
- English name
- HEXADECYL[2-([P-METHOXYBENZYL]-2-PYRIMIDINYLAMINO)ETHYL]DIMETHYL-AMMONIUM BROMIDE
- Molecular formula
- C32H55BrN4O
- Molecular weight
- 591.71
Names & synonyms
THONZONIUM BROMIDE553-08-2ThonzideTonzonium bromideBromuro de tonzonioBromure de tonzoniumTonzonii bromidumNC 1264DTXSID1045326NSC-5648JI2B19CR0RNC-1264
Show more names
Tonzonium1-HexadecanaminiumThonzonium Bromide (200 mg)Thonzonium Bromide, 10 mM in DMSOThonzonium Bromide (200 mg) (DISCONTINUED)cetyl-dimethyl-[2-[p-anisyl(2-pyrimidyl)amino]ethyl]ammonium bromide
DTXCID9025326NSC56481-Hexadecanaminium, N-(2-(((4-methoxyphenyl)methyl)-2-pyrimidinylamino)ethyl)-N,N-dimethyl-, bromideAmmonium, hexadecyl(2-((p-methoxybenzyl)-2-pyrimidinylamino)ethyl)dimethyl-, bromidetonzonio bromuroRefChem:189695209-032-1Thonzonium (bromide)
Database identifiers
- CAS
553-08-2- PubChem CID
- 11102
Properties
Computed structural properties
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 22
- Heavy atoms
- 38
- Formal charge
- 0
- Complexity
- 515
Experimental & physicochemical properties
Human Drugs
FDA approved drugs -> Active ingredient
FDA approved drugs -> Active ingredient
Physicochemical properties
- Melting point
- 91 · 91-92°
- storage temp.
- Inert atmosphere,Room Temperature
- solubility
- DMSO (Slightly), Methanol (Slightly)
- form
- Solid
- color
- White to Off-White
- Stability
- Hygroscopic
- FDA UNII
- 2 B19CR0R · JI2B19CR0R
- Symbol(GHS)
- 5 · GHS05,GHS07
- Signal word
- Danger
- Hazard statements
- 302 · H302+H312+H332-H315-H318-H335
- Precautionary statements
- 261 · P261-P280-P301+P312+P330-P305+P351+P338+P310
- Hazard Codes
- Xn
- Risk Statements
- 20 · 20/21/22-36/37/38-41-37/38
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory InformationChemical: 1-Hexadecanaminium, N-[2-[[(4-methoxyphenyl)methyl]-2-pyrimidinylamino]ethyl]-N,N-dimethyl-, bromide
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- wgk
- 3
- hs_code
- 2933599550
- risk_code
- 20/21/22-36/37/38-41-37/38
- Signal word
- Danger
- Symbol(GHS)
- GHS05,GHS07
- hazard_code
- Xn
- safety_code
- 26-36
- Hazard statements
- H302+H312+H332-H315-H318-H335
- Precautionary statements
- P261-P280-P301+P312+P330-P305+P351+P338+P310
Chemistry & industry
Applications
Usesneuromuscular blocker
UsesDetergent.
UsesThonzonium Bromide is an inhibitor of ATP-dependent proton transport in vacuolar membranes. Surfactant.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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