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Home> Hot Product Listed P   > Pyridinium,1-(phenylmethyl)-, Et Me derivs., chlorides
68909-18-2 structure

Pyridinium,1-(phenylmethyl)-, Et Me derivs., chlorides

Iupac Name:1-benzyl-1-methyl-2H-pyridin-1-ium;chloride
CAS No.:68909-18-2
EINECS(EC#): 272-695-0
Molecular Weight:221.728
Molecular Formula:C13H16ClN (isomer)
Names and Identifiers
Synonyms

1-(Phenylmethyl)pyridinium Et Me derivs., chlorides 1-(Phenylmethyl)pyridinium, ethyl methyl derivs., chlorides 1-benzyl-1-methyl-1,2-dihydropyridinium chloride 1-benzyl-1-methyl-2h-pyridin-1-ium chloride Alkyl pyridine, benzylchloride quaternized Benzyl (C1-C2)-alkylpyridinium chloride Benzyl-C1-2-alkylpyridinium chloride HE047962 HE330257 HE380007 MOLPORT-042-652-702 PYRIDINE-BENZYL QUATERNARY AMMONIUM COMPOUND pyridinium, 1-(phenylmethyl)-, et me derivs., chlorides Pyridinium, 1-(phenylmethyl)-, ethyl methyl derivs., chlorides Pyridinium, ethyl-1-(phenylmethyl)-, chloride, mixed with methyl-1-(phenylmethyl)pyridinium chloride pyridinium,methyl-1-benzyl-,chloride Quaternized Alkyl Pyridine (Akolidine 10 based) Quaternized Alkyl Pyridine (Alkolidine 11 based) SC-17056 SCHEMBL16632651 Uniquat(R) PB-750 Uniquat(R) PB-801

Inchi
InChI=1S/C13H16N.ClH/c1-14(10-6-3-7-11-14)12-13-8-4-2-5-9-13;/h2-10H,11-12H2,1H3;1H/q+1;/p-1
InChkey
NBNVYJFZJWMHPR-UHFFFAOYSA-M
Canonical Smiles
C[N+]1(CC=CC=C1)CC2=CC=CC=C2.[Cl-]
Reach Info
This substance has been officially registered by enterprises.
ECHA (EU chemicals Management Agency) published the completed registration file as follows:
Completed registration file:
Registered as ubmitted Total tonnage band  
FULL JOINT 100_1000 view >
Registered companies:
Registrant / Supplier details Latest dossier received
Baker Hughes Ltd 2011
more >
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Flammable liquids, Category 3

Skin corrosion, Category 1B

Hazardous to the aquatic environment, short-term (Acute) - Category Acute 1

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word

Warning

Hazard statement(s)

H314 Causes severe skin burns and eye damage

H400 Very toxic to aquatic life

Precautionary statement(s)
Prevention

P210 Keep away from heat, hot surfaces, sparks, open flames and other ignition sources. No smoking.

P233 Keep container tightly closed.

P240 Ground and bond container and receiving equipment.

P241 Use explosion-proof [electrical/ventilating/lighting/...] equipment.

P242 Use non-sparking tools.

P243 Take action to prevent static discharges.

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

P260 Do not breathe dust/fume/gas/mist/vapours/spray.

P264 Wash ... thoroughly after handling.

P273 Avoid release to the environment.

Response

P303+P361+P353 IF ON SKIN (or hair): Take off immediately all contaminated clothing. Rinse skin with water [or shower].

P370+P378 In case of fire: Use ... to extinguish.

P301+P330+P331 IF SWALLOWED: Rinse mouth. Do NOT induce vomiting.

P363 Wash contaminated clothing before reuse.

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

P310 Immediately call a POISON CENTER/doctor/…

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

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

P391 Collect spillage.

Storage

P403+P235 Store in a well-ventilated place. Keep cool.

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:221.728g/mol
  • Molecular Formula:C13H16ClN
  • Compound Is Canonicalized:True
  • Exact Mass:221.097
  • Monoisotopic Mass:221.097
  • Complexity:236
  • Rotatable Bond Count:2
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:1
  • Topological Polar Surface Area:0A^2
  • Heavy Atom Count:15
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:1
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:2
  • CACTVS Substructure Key Fingerprint: AAADceByAAAEAAAAAAAAAAAAAAAAAAAAAAAwQAAAAAAAAAABAAAAHAAAAAAADADBGAQyAIMAAACA AiBGQACCAAAgAgAIiAAIBIgIICKAkRGEIAhggACIiAcQgAAOAAAAAAAAAAAAAAAAAAAAAAAAAAAA AA==
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  • Tel:+86-21-20255798
  • Fax:+86-21-20252853
  • Tel:+86-21-52699951
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