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CAS	23662-66-0
Also known as: 23662-66-0, 1-benzyl-4-methylpyridinium chloride, N-benzyl-4-methyl-pyridinium chloride, Pyridinium, 4-methyl-1-(phenylmethyl)-, chloride (1:1), 1-benzyl-4-methylpyridin-1-ium chloride, 1-benzyl-4-methylpyridin-1-ium;chloride
Molecular Formula
C13H14ClN
Molecular Weight
219.71  g/mol
InChI Key
LJHMBIINLKLHSI-UHFFFAOYSA-M

1 2D Structure

CAS	23662-66-0

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
1-benzyl-4-methylpyridin-1-ium;chloride
2.1.2 InChI
InChI=1S/C13H14N.ClH/c1-12-7-9-14(10-8-12)11-13-5-3-2-4-6-13;/h2-10H,11H2,1H3;1H/q+1;/p-1
2.1.3 InChI Key
LJHMBIINLKLHSI-UHFFFAOYSA-M
2.1.4 Canonical SMILES
CC1=CC=[N+](C=C1)CC2=CC=CC=C2.[Cl-]
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 23662-66-0

2. 1-benzyl-4-methylpyridinium Chloride

3. N-benzyl-4-methyl-pyridinium Chloride

4. Pyridinium, 4-methyl-1-(phenylmethyl)-, Chloride (1:1)

5. 1-benzyl-4-methylpyridin-1-ium Chloride

6. 1-benzyl-4-methylpyridin-1-ium;chloride

7. Nsc 157552

8. Schembl3278043

9. Dtxsid90446094

10. N-benzyl-4-methylpyridinium Chloride

11. Nsc157552

12. Akos022183530

13. Nsc-157552

14. 1-benzyl-4-methyl-pyridin-1-ium Chloride

15. Db-311840

16. Cs-0006816

17. A816828

18. 4-methyl-1-(phenylmethyl)-pyridinium Chloride (1:1)

2.3 Create Date
2006-10-26
3 Chemical and Physical Properties
Molecular Weight 219.71 g/mol
Molecular Formula C13H14ClN
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Exact Mass g/mol
Monoisotopic Mass g/mol
Topological Polar Surface Area3.9
Heavy Atom Count15
Formal Charge0
Complexity153
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count2
Flag China
Digital Content Digital Content
URL Supplier Web Content
540737-29-9
Tofacitinib Citrate
Cangzhou Enke Pharma Tech Co.,ltd. is located in Cangzhou City, Hebei province ,where is a famous petrole...
Cangzhou Enke Pharma Tech Co.,ltd. is located in Cangzhou City, Hebei province ,where is a famous petroleum chemical industry city in China. Enke Pharma a high-tech enterprise ,and we are dedicated to developing and manufacturing new api, intermediates and pharmaceutical fine chemicals. Enke Pharma currently employs more than 20 technical staffs, including 2 doctors and 8 masters . At the same time our company established cooperative production bases in Cangzhou city Hebei province and Fuzhou city Jiangxi province. In addition to our own growing , we ‘d like to provide all-round service to our customers , like custom development, custom production and technical consulting.
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