Benzalkonium chloride structure, CAS 8001-54-5

Benzalkonium chloride

CAS Number8001-54-5

SynonymsBenzenemethanaminium, N,N-dimethyl-N-tridecyl-, chloride (1:1); MFCD00050250; N-Benzyl-N,N-dimethyltridecan-1-aminium chloride; EINECS 264-151-6; N-Benzyl-N,N-dimethyl-1-tridecanaminium chloride; Alkyldimethylbenzylammonium Chloride; Benzalkonium Chloride

Molecular FormulaC6H5CH2N(CH3)2RCl(R=C8H17toC18H37)

Molecular Weight354.013

Purity98.00%

Density0.98

Boiling Point>100°C/760mmHg

Melting Point

Flash Point

AppearanceLight yellow liquid

EINECS

MSDSChineseEnglish

Symbol

Signal Word

Cat. No.: 2A-9034201 Purity: 98.00%
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Quality Control of [ 8001-54-5 ] Purity: 98.00% SDS Specification MoL

Chemical & Physical Properties
CAS Number8001-54-5
Catalog No.2A-9034201
Chinese Name苯扎氯铵
SynonymsBenzenemethanaminium, N,N-dimethyl-N-tridecyl-, chloride (1:1); MFCD00050250; N-Benzyl-N,N-dimethyltridecan-1-aminium chloride; EINECS 264-151-6; N-Benzyl-N,N-dimethyl-1-tridecanaminium chloride; Alkyldimethylbenzylammonium Chloride; Benzalkonium Chloride
Molecular FormulaC6H5CH2N(CH3)2RCl(R=C8H17toC18H37)
Molecular Weight354.013
Purity98.00
Density0.98
Boiling Point>100°C/760mmHg
AppearanceLight yellow liquid
Storage ConditionPacked in plastic barrels and stored in a cool and
Packagingjavascript:void(0);
ApplicationBenzalkonium chloride is a potent antimicrobial agent used as a preservative in eye drops.
PubChem ID8150005
MDL NumberMFCD00145757
SMILES[Cl-].[N+](CCCCCCCCCC)(Cc1ccccc1)(C)C
InChI1S/C19H34N.ClH/c1-4-5-6-7-8-9-10-14-17-20(2,3)18-19-15-12-11-13-16-19;/h11-13,15-16H,4-10,14,17-18H2,1-3H3;1H/q+1;/p-1
InChI KeyTTZLKXKJIMOHHG-UHFFFAOYSA-M
NACRES CodeNA.24
UNSPSC41116107
MSDSmsds/34201_1_8001_54_5.pdf
BioactivityBenzalkonium chloride is a potent anti-microbial agent, used as a preservative in eye drops. Related Catalog Signaling Pathways >> Anti-infection >> Bacterial Research Areas >> Infection In Vitro Benzalkonium chloride (0.0001%-0.5%) results in a dose-dependent cytotoxicity in cells. Benzalkonium chloride also shows cytotoxicity against human keratinocytes, with 50% loss of viability of 4 μM. Benzalkonium chloride shows different results in NHEK and NB1RGB cell cultures, and the ED50 of 3.9 and 62 μM, respectively. The clinically used concentration (0.01% Benzalkonium chloride) significantly reduces cell viability, with only 14%-19% of nasal epithelial cells surviving the treatment[1]. In Vivo Benzalkonium chloride (0.02%) causes no abnormalities in the nasal epithelium of the monkeys after light and electron microscopical examination. In 4-5 week-old SD rats, 0.01% and 0.1% Benzalkonium chloride induce a time-dependent increase in the thickness of the nasal respiratory epithelium[1]. References [1]. Johnson NF. Pulmonary Toxicity of Benzalkonium Chloride. J Aerosol Med Pulm Drug Deliv. 2017 Jul 6. Chemical & Physical Properties Density 0.98 Boiling Point >100°C/760mmHg Molecular Formula C6H5CH2N(CH3)2RCl(R=C8H17toC18H37) Molecular Weight 354.013 Exact Mass 353.284943 LogP 7.76610 Storage condition 2-8°C Stability Stable. Incompatible with strong oxidizing agents, moisture. Hygroscopic.
Use ofBenzalkonium chloride is a potent anti-microbial agent, used as a preservative in eye drops. Properties Name benzalkonium chloride Synonym More Synonyms Benzalkonium chloride Biological Activity Description Benzalkonium chloride is a potent anti-microbial agent, used as a preservative in eye drops. Related Catalog Signaling Pathways >> Anti-infection >> Bacterial Research Areas >> Infection In Vitro Benzalkonium chloride (0.0001%-0.5%) results in a dose-dependent cytotoxicity in cells. Benzalkonium chloride also shows cytotoxicity against human keratinocytes, with 50% loss of viability of 4 μM. Benzalkonium chloride shows different results in NHEK and NB1RGB cell cultures, and the ED50 of 3.9 and 62 μM, respectively. The clinically used concentration (0.01% Benzalkonium chloride) significantly reduces cell viability, with only 14%-19% of nasal epithelial cells surviving the treatment[1]. In Vivo Benzalkonium chloride (0.02%) causes no abnormalities in the nasal epithelium of the monkeys after light and electron microscopical examination. In 4-5 week-old SD rats, 0.01% and 0.1% Benzalkonium chloride induce a time-dependent increase in the thickness of the nasal respiratory epithelium[1]. References [1]. Johnson NF. Pulmonary Toxicity of Benzalkonium Chloride. J Aerosol Med Pulm Drug Deliv. 2017 Jul 6. Chemical & Physical Properties Exact Mass 353.284943 LogP 7.76610 Stability Stable. Incompatible with strong oxidizing agents, moisture. Hygroscopic.
Transport InfoProduct Name: Benzalkonium Chloride
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