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5613-08-1 | 4-Carbamoyl-1-methylpyridiniumiodide
CAS No: 5613-08-1 Catalog No: AG00DPFT MDL No:
Product Description
Catalog Number:
AG00DPFT
Chemical Name:
4-Carbamoyl-1-methylpyridiniumiodide
CAS Number:
5613-08-1
IUPAC Name:
1-methylpyridin-1-ium-4-carboxamide;iodide
InChI:
InChI=1S/C7H8N2O.HI/c1-9-4-2-6(3-5-9)7(8)10;/h2-5H,1H3,(H-,8,10);1H
InChI Key:
PQTCYQMUVMCXKX-UHFFFAOYSA-N
NSC Number:
87280
Properties
Complexity:
128
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.976g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
264.066g/mol
Monoisotopic Mass:
263.976g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
47A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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