Home Carbonyls 4-(Ethoxycarbonyl)-1-methylquinolin-1-ium iodide

4-(Ethoxycarbonyl)-1-methylquinolin-1-ium iodide

CAS No.:
56153-32-3
Catalog Number:
AG01EWGO
Molecular Formula:
C13H14INO2
Molecular Weight:
343.1602
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
96%
1 week
United States
$163
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Product Description
Catalog Number:
AG01EWGO
Chemical Name:
4-(Ethoxycarbonyl)-1-methylquinolin-1-ium iodide
CAS Number:
56153-32-3
Molecular Formula:
C13H14INO2
Molecular Weight:
343.1602
MDL Number:
MFCD00957832
IUPAC Name:
ethyl 1-methylquinolin-1-ium-4-carboxylate;iodide
InChI:
InChI=1S/C13H14NO2.HI/c1-3-16-13(15)11-8-9-14(2)12-7-5-4-6-10(11)12;/h4-9H,3H2,1-2H3;1H/q+1;/p-1
InChI Key:
ISOWGMALYGPRPU-UHFFFAOYSA-M
SMILES:
CCOC(=O)c1cc[n+](c2c1cccc2)C.[I-]
NSC Number:
138312
Properties
Complexity:
254  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
343.007g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
343.164g/mol
Monoisotopic Mass:
343.007g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
30.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties