8.43983
Benzethonium chloride
for synthesis
Synonym(s):
Benzethonium chloride, N-Benzyl-N,N-dimethyl-N-[4-(1.1.3.3-tetramethylbutyl)-phenoxyethoxyethyl]ammonium chloride, Benzethonium chloride
About This Item
vapor pressure
<0.001 hPa ( 25 °C)
Quality Level
form
solid
autoignition temp.
380 °C
potency
295 mg/kg LD50, oral (Rat)
pH
5-6.5 (10 g/L in H2O)
mp
160-166 °C
bulk density
440 kg/m3
storage temp.
15-25°C
SMILES string
[Cl-].[N+](CCOCCOc2ccc(cc2)C(CC(C)(C)C)(C)C)(Cc1ccccc1)(C)C
InChI
1S/C27H42NO2.ClH/c1-26(2,3)22-27(4,5)24-13-15-25(16-14-24)30-20-19-29-18-17-28(6,7)21-23-11-9-8-10-12-23;/h8-16H,17-22H2,1-7H3;1H/q+1;/p-1
InChI key
UREZNYTWGJKWBI-UHFFFAOYSA-M
Application
- Development of biologically active ionic liquids: Research highlighted the synthesis of new ionic liquids incorporating the benzethonium cation, which show promising SAR induction and antimicrobial properties, potentially useful in pest management and disease control applications (Czerwoniec et al., 2024).
Signal Word
Danger
Hazard Statements
Precautionary Statements
Hazard Classifications
Acute Tox. 3 Oral - Aquatic Acute 1 - Aquatic Chronic 1 - Eye Dam. 1 - Skin Corr. 1B
Storage Class Code
6.1A - Combustible, acute toxic Cat. 1 and 2 / very toxic hazardous materials
WGK
WGK 2
Regulatory Listings
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ISHL Indicated Name
Substances Subject to be Indicated Names
ISHL Notified Names
Substances Subject to be Notified Names
Certificates of Analysis (COA)
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