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Home> Hot Product Listed B   > benzyldimethyl[2-[(1-oxoallyl)oxy]ethyl]ammonium chloride
93-10-7 structure

benzyldimethyl[2-[(1-oxoallyl)oxy]ethyl]ammonium chloride

Iupac Name:quinoline-2-carboxylic acid
CAS No.:93-10-7
Molecular Weight:173.17
Molecular Formula:C12H12O5 (isomer)
Names and Identifiers
Synonyms

(Acryloyloxyethyl)benzyldimethylammonium chloride [2-(acryloyloxy)ethyl]benzyldimethylammonium chloride 2-(acryloyloxy)-n-benzyl-n,n-dimethylethanaminium chloride 9330J8T133 A827863 AC1L4QN6 AC1Q1SJR acm46830222 acryloyloxyethyl-n,n-dimethylbenzylammonium chloride AKOS025296159 benzenemethanaminium, n,n-dimethyl-n-(2-((1-oxo-2-propen-1-yl)oxy)ethyl)-, chloride (1:1) benzenemethanaminium, n,n-dimethyl-n-(2-((1-oxo-2-propenyl)oxy)ethyl)-, chloride benzenemethanaminium, n,n-dimethyl-n-[2-[(1-oxo-2-propen-1-yl)oxy]ethyl]-, chloride (1:1) benzenemethanaminium, n,n-dimethyl-n-[2-[(1-oxo-2-propenyl)oxy]ethyl]-, chloride Benzenemethanaminium, N,N-dimethyl-N-2-(1-oxo-2-propenyl)oxyethyl-, chloride benzyldimethyl(2-((1-oxoallyl)oxy)ethyl)ammonium chloride benzyl-dimethyl-(2-prop-2-enoyloxyethyl)azanium chloride benzyldimethyl[2-(prop-2-enoyloxy)ethyl]azanium chloride benzyldimethyl[2-[ oxy]ethyl]ammoniumchloride Benzyldimethyl[2-[(1-oxoallyl)oxy]ethyl]ammonium chloride,80% in water Benzyldimethyl[2-[(1-oxoallyl)oxy]ethyl]ammoniumchlorid CTK1D6459 dimethyl-(phenylmethyl)-(2-prop-2-enoyloxyethyl)azanium chloride dimethyl-[2-(1-oxoprop-2-enoxy)ethyl]-(phenylmethyl)ammonium chloride DTXSID9050430 einecs 256-283-8 ethalkonium chloride acrylate/hema/styrene copolymer fch2798094 methacryloyl oxyethyl dimethylbenzyl ammonium chloride n-(2-acryloyloxyethyl)-n-benzyl-n,n-dimethylammonium chloride OR062239 SCHEMBL543368 unii-9330j8t133 ZGCZDEVLEULNLJ-UHFFFAOYSA-M

Inchi
InChI=1S/C10H7NO2/c12-10(13)9-6-5-7-3-1-2-4-8(7)11-9/h1-6H,(H,12,13)
InChkey
LOAUVZALPPNFOQ-UHFFFAOYSA-N
Canonical Smiles
C1=CC=C2C(=C1)C=CC(=N2)C(=O)O
Properties
Melting Point
156-158 °C(lit.)
Refractive Index
1.5200 (estimate)
Flash Point
158.7°C
Safety and Handling
Risk Statements
36/37/38-23/24/25
Safety Statements
26-36-37/39-45-36/37/39
Reach Info
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Skin irritation, Category 2

Eye irritation, Category 2

Specific target organ toxicity \u2013 single exposure, Category 3

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word

Warning

Hazard statement(s)

H315 Causes skin irritation

H319 Causes serious eye irritation

H335 May cause respiratory irritation

Precautionary statement(s)
Prevention

P264 Wash ... thoroughly after handling.

P280 Wear protective gloves/protective clothing/eye protection/face protection.

P261 Avoid breathing dust/fume/gas/mist/vapours/spray.

P271 Use only outdoors or in a well-ventilated area.

Response

P302+P352 IF ON SKIN: Wash with plenty of water/...

P321 Specific treatment (see ... on this label).

P332+P313 If skin irritation occurs: Get medical advice/attention.

P362+P364 Take off contaminated clothing and wash it before reuse.

P305+P351+P338 IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.

P337+P313 If eye irritation persists: Get medical advice/attention.

P304+P340 IF INHALED: Remove person to fresh air and keep comfortable for breathing.

P312 Call a POISON CENTER/doctor/\u2026if you feel unwell.

Storage

P403+P233 Store in a well-ventilated place. Keep container tightly closed.

P405 Store locked up.

Disposal

P501 Dispose of contents/container to ...

2.3 Other hazards which do not result in classification

none

Computational chemical data
  • Molecular Weight:173.17g/mol
  • Molecular Formula:C12H12O5
  • Compound Is Canonicalized:True
  • XLogP3-AA:1.6
  • Exact Mass:173.048
  • Monoisotopic Mass:173.048
  • Complexity:205
  • Rotatable Bond Count:1
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:3
  • Topological Polar Surface Area:50.2A^2
  • Heavy Atom Count:13
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
  • CACTVS Substructure Key Fingerprint: AAADcYByMAAAAAAAAAAAAAAAAAAAAAAAAAA8QAAAAAAAAACx8AAAHgAACAAADAiBngAwyPIIEgCo AyTyTASCgCAnAiAImCGwbNgKJvLAlbGEcQhkwAHY2YeYyLCOAAAAAAACAAAAAAAAAAQAAAAAAAAA AA==
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