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51843-14-2

51843-14-2 | 1,2-Dimethylisoquinolin-2-ium iodide

CAS No: 51843-14-2 Catalog No: AG01EWBJ MDL No:MFCD00540399

Product Description

Catalog Number:
AG01EWBJ
Chemical Name:
1,2-Dimethylisoquinolin-2-ium iodide
CAS Number:
51843-14-2
Molecular Formula:
C11H12IN
Molecular Weight:
285.1242
MDL Number:
MFCD00540399
IUPAC Name:
1,2-dimethylisoquinolin-2-ium;iodide
InChI:
InChI=1S/C11H12N.HI/c1-9-11-6-4-3-5-10(11)7-8-12(9)2;/h3-8H,1-2H3;1H/q+1;/p-1
InChI Key:
XTFWLHHOAKCHDX-UHFFFAOYSA-M
SMILES:
C[n+]1ccc2c(c1C)cccc2.[I-]
NSC Number:
54305

Properties

Complexity:
155  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.001g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
285.128g/mol
Monoisotopic Mass:
285.001g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
3.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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