CAS 18241-36-6 | 1,2-dimethylquinolinium iodide | CAS Number 18241-36-6

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18241-36-6 | 1,2-dimethylquinolinium iodide

CAS No: 18241-36-6 Catalog No: AG00J63S MDL No:MFCD00050320

Product Description

Catalog Number:

AG00J63S

Chemical Name:

1,2-dimethylquinolinium iodide

CAS Number:

18241-36-6

Molecular Formula:

C11H12N+

Molecular Weight:

158.2197

MDL Number:

MFCD00050320

IUPAC Name:

1,2-dimethylquinolin-1-ium

InChI:

InChI=1S/C11H12N/c1-9-7-8-10-5-3-4-6-11(10)12(9)2/h3-8H,1-2H3/q+1

InChI Key:

KEOLYURDXNRJEY-UHFFFAOYSA-N

SMILES:

C[n+]1c(C)ccc2c1cccc2

Properties

Complexity:

155

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

158.097g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

158.224g/mol

Monoisotopic Mass:

158.097g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

3.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.1

Literature

Title	Journal
1-Methyl-2-[(E)-2-(2-thien-yl)ethen-yl]quinolinium 4-bromo-benzene-sulfonate.	Acta crystallographica. Section E, Structure reports online 20100501
2-[(E)-2-(4-Ethoxy-phen-yl)ethen-yl]-1-methyl-quinolinium iodide dihydrate.	Acta crystallographica. Section E, Structure reports online 20100401
1-Methyl-2-[(E)-2-(2-thien-yl)ethen-yl]quinolinium iodide.	Acta crystallographica. Section E, Structure reports online 20080801
(E)-2-[4-(Dimethyl-amino)styr-yl]-1-methyl-quinolinium iodide sesquihydrate.	Acta crystallographica. Section E, Structure reports online 20080501
(E)-2-[4-(Dimethyl-amino)styr-yl]-1-methyl-quinolinium 4-methoxy-benzene-sulfonate monohydrate.	Acta crystallographica. Section E, Structure reports online 20080301