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125583-32-6

125583-32-6 | Pyridinium, 4-[(aminocarbonyl)amino]-1-methyl-, iodide (1:1)

CAS No: 125583-32-6 Catalog No: AG000NWK MDL No:

Product Description

Catalog Number:
AG000NWK
Chemical Name:
Pyridinium, 4-[(aminocarbonyl)amino]-1-methyl-, iodide (1:1)
CAS Number:
125583-32-6
Molecular Formula:
C7H10IN3O
Molecular Weight:
279.0783
IUPAC Name:
(1-methylpyridin-1-ium-4-yl)urea;iodide
InChI:
InChI=1S/C7H9N3O.HI/c1-10-4-2-6(3-5-10)9-7(8)11;/h2-5H,1H3,(H2,8,11);1H
InChI Key:
OWXBPBZSAHXXOG-UHFFFAOYSA-N
SMILES:
NC(=O)Nc1cc[n+](cc1)C.[I-]

Properties

Complexity:
141  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.987g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
279.081g/mol
Monoisotopic Mass:
278.987g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
59A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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