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Benzylethyldimethylammonium chloride

HCID 78872
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Basic information

CAS
5197-80-8
Standard SMILES
CC[N+](C)(C)Cc1ccccc1.[Cl-]
InChIKey
IUHDTQIYNQQIBP-UHFFFAOYSA-M
Molecular formula
C11H18N.Cl
Average molar mass
199.72 g/mol
Monoisotopic mass
199.1127773

Names & identifiers

Preferred name
Benzylethyldimethylammonium chloride
IUPAC
benzyl-ethyl-dimethylazanium chloride
English name
benzylethyldimethylammonium chloride
Molecular formula
C11H18ClN
Molecular weight
199.72032

Names & synonyms

Benzylethyldimethylammonium chloride5197-80-8EINECS 225-985-650YXD1YX7GBenzenemethanaminium, N-ethyl-N,N-dimethyl-, chlorideBenzenemethanaminium, N-ethyl-N,N-dimethyl-, chloride (1:1)ETHYLDIMETHYLBENZYLAMMONIUM CHLORIDERefChem:566957Benzenemethanaminium, NethylN,Ndimethyl, chloride225-985-6n-benzyl-n,n-dimethylethanaminium chlorideUNII-50YXD1YX7G
Show more names
benzyl-ethyl-dimethylazanium,chlorideN-ethyl-N,N-dimethylbenzylammonium chlorideN-ETHYL-N,N-DIMETHYLBENZENEMETHANAMINIUM CHLORIDE)
Benzalkonium Chloride; RoccalSCHEMBL139563DTXSID10884136IUHDTQIYNQQIBP-UHFFFAOYSA-MBenzalkonium chloride C2 (BAC C2)dimethyl ethylbenzyl ammonium chlorideDB-253929NS00045562

Database identifiers

CAS
5197-80-8
PubChem CID
78872
DTXSID
DTXSID10884136
UNII
50YXD1YX7G
EC Number
225-985-6

Properties

Computed structural propertiesFilling in

Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
3
Heavy atoms
13
Formal charge
0
Complexity
123

Experimental & physicochemical properties

Chemical ClassesNitrogen Compounds -> Quaternary Amines
Physical Description10-30% Aqueous solution: Liquid with a bland odor; [P.B. Gast and Sons MSDS]

Physicochemical properties

FDA UNII
50 YXD1YX7G · 50YXD1YX7G
EPA Substance Registry System
Benzenemethanaminium, N-ethyl-N,N-dimethyl-, chloride (5197-80-8)
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
315 · H315-H319
Precautionary statements
264 · P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
TSCA
TSCA listed

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 · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Regulatory Information · 2 items

Chemical: Benzenemethanaminium, N-ethyl-N,N-dimethyl-, chloride

Benzenemethanaminium, N-ethyl-N,N-dimethyl-, chloride: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

Hazards Summary10-30% Aqueous solution: May cause severe eye irritation and corneal injury; [P.B. Gast and Sons MSDS]
Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

tsca
TSCA listed
Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H315-H319
Precautionary statements
P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362

Chemistry & industry

Uses & manufacturing

Uses · 2 items

Used as a sanitizer/disinfectant cleaner; [P.B. Gast and Sons MSDS]

Using Disinfectants or Biocides [Category: Clean]

Household ProductsInformation on 5 consumer products that contain Benzylethyldimethylammonium chloride in the following categories is provided:
General Manufacturing InformationBenzenemethanaminium, N-ethyl-N,N-dimethyl-, chloride (1:1): ACTIVE

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Compound notes

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