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111317-33-0

111317-33-0 | Pyridinium, 4-[(4-methoxyphenyl)azo]-1-methyl-, iodide

CAS No: 111317-33-0 Catalog No: AG007T5Z MDL No:

Product Description

Catalog Number:
AG007T5Z
Chemical Name:
Pyridinium, 4-[(4-methoxyphenyl)azo]-1-methyl-, iodide
CAS Number:
111317-33-0
Molecular Formula:
C13H14IN3O
Molecular Weight:
355.1742
IUPAC Name:
(4-methoxyphenyl)-(1-methylpyridin-1-ium-4-yl)diazene;iodide
InChI:
InChI=1S/C13H14N3O.HI/c1-16-9-7-12(8-10-16)15-14-11-3-5-13(17-2)6-4-11;/h3-10H,1-2H3;1H/q+1;/p-1
InChI Key:
DZMJYDVJAVMOSH-UHFFFAOYSA-M
SMILES:
COc1ccc(cc1)N=Nc1cc[n+](cc1)C.[I-]

Properties

Complexity:
241  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
355.018g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
355.179g/mol
Monoisotopic Mass:
355.018g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
37.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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