2-Trimethylaminoethyl 1'-ethylisothiuronium bromide supplier

Name
(2E)-1-ethyl-2-({[2-(trimethylammonio)ethyl]sulfanyl}methylidene)hydrazinium dibromide
EINECS
CAS No. 32458-57-4
Density g/cm³
Solubility
Melting Point
Formula C₈H₂₀N₃S•Br•BrH
Boiling Point °Cat760mmHg
Molecular Weight 351.20
Flash Point °C
Transport Information
Appearance
Safety Poison by subcutaneous, intravenous, and intraperitoneal routes. When heated to decomposition it emits toxic fumes of SO_x, NO_x, NH₃, and HBr.
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms
PSA
LogP

2-Trimethylaminoethyl 1'-ethylisothiuronium bromide Chemical Properties

Molecule structure of 2-Trimethylaminoethyl 1'-ethylisothiuronium bromide hydrobromide (CAS NO.32458-57-4) :

IUPAC Name: 2-[(E)-(ethylazaniumyl)iminomethyl]sulfanylethyl-trimethylazanium dibromide
Molecular Weight: 351.14544 g/mol
Molecular Formula: C₈H₂₁Br₂N₃S
H-Bond Donor: 1
H-Bond Acceptor: 3
Rotatable Bond Count: 6
Exact Mass: 350.980247
MonoIsotopic Mass: 348.982294
Topological Polar Surface Area: 29
Heavy Atom Count: 14
Complexity: 129
Canonical SMILES: CC[NH2+]N=CSCC[N+](C)(C)C.[Br-].[Br-]
Isomeric SMILES: CC[NH2+]/N=C/SCC[N+](C)(C)C.[Br-].[Br-]
InChI: InChI=1S/C8H20N3S.2BrH/c1-5-9-10-8-12-7-6-11(2,3)4;;/h8-9H,5-7H2,1-4H3;2*1H/q+1;;/p-1/b10-8+;;
InChIKey of 2-Trimethylaminoethyl 1'-ethylisothiuronium bromide hydrobromide (CAS NO.32458-57-4) : JJTPWBUWNKGQRW-PIHABLKOSA-M

2-Trimethylaminoethyl 1'-ethylisothiuronium bromide Toxicity Data With Reference

1.	ipr-mus LD50:95 mg/kg	CPBTAL Chemical and Pharmaceutical Bulletin. 23 (1975),1639.
2.	scu-mus LD50:102 mg/kg	CPBTAL Chemical and Pharmaceutical Bulletin. 23 (1975),1639.
3.	ivn-mus LD50:81,800 µg/kg	CPBTAL Chemical and Pharmaceutical Bulletin. 23 (1975),1639.

2-Trimethylaminoethyl 1'-ethylisothiuronium bromide Safety Profile

Poison by subcutaneous, intravenous, and intraperitoneal routes. When heated to decomposition it emits toxic fumes of SO_x, NO_x, NH₃, and HBr.

2-Trimethylaminoethyl 1'-ethylisothiuronium bromide Specification

2-Trimethylaminoethyl 1'-ethylisothiuronium bromide hydrobromide (CAS NO.32458-57-4) is also called (2-(((Ethylamino)iminomethyl)thio)ethyl)trimethyl ammonium bromide hydrobromide ; Ammonium, (2-((ethylamidino)thio)ethyl)trimethyl-, bromide, monohydrobromide ; S-(2-Trimethylaminoethyl)-1'-ethylisothiuronium bromide hydrobromide ; Ammonium, (2-(((ethylamino)iminomethyl)thio)ethyl)trimethyl-, bromide, monohydrobromide ; Ethanaminium, 2-(((ethylamino)imino)methylthio)-N,N,N-trimethyl-, bromide, monohydrobromide .

Product Name

(2E)-1-ethyl-2-({[2-(trimethylammonio)ethyl]sulfanyl}methylidene)hydrazinium dibromide

2-Trimethylaminoethyl 1'-ethylisothiuronium bromide Chemical Properties

2-Trimethylaminoethyl 1'-ethylisothiuronium bromide Toxicity Data With Reference

2-Trimethylaminoethyl 1'-ethylisothiuronium bromide Safety Profile

2-Trimethylaminoethyl 1'-ethylisothiuronium bromide Specification

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