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1332581-59-5 | 4-Pyridinol, 3-amino-5-iodo-, hydrochloride (1:1)
CAS No: 1332581-59-5 Catalog No: AG0014GH MDL No:
Product Description
Catalog Number:
AG0014GH
Chemical Name:
4-Pyridinol, 3-amino-5-iodo-, hydrochloride (1:1)
CAS Number:
1332581-59-5
Molecular Formula:
C5H6ClIN2O
Molecular Weight:
272.4714
IUPAC Name:
3-amino-5-iodo-1H-pyridin-4-one;hydrochloride
InChI:
InChI=1S/C5H5IN2O.ClH/c6-3-1-8-2-4(7)5(3)9;/h1-2H,7H2,(H,8,9);1H
InChI Key:
ORCGMVUCDASTGU-UHFFFAOYSA-N
SMILES:
Oc1c(N)cncc1I.Cl
Properties
Complexity:
207
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.921g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
272.47g/mol
Monoisotopic Mass:
271.921g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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