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88499-66-5 | 2,4(1H,3H)-Pyridinedione, 5-iodo-6-methyl-
CAS No: 88499-66-5 Catalog No: AG008ABS MDL No:
Product Description
Catalog Number:
AG008ABS
Chemical Name:
2,4(1H,3H)-Pyridinedione, 5-iodo-6-methyl-
CAS Number:
88499-66-5
Molecular Formula:
C6H6INO2
Molecular Weight:
251.0218
IUPAC Name:
5-iodo-6-methyl-1H-pyridine-2,4-dione
InChI:
InChI=1S/C6H6INO2/c1-3-6(7)4(9)2-5(10)8-3/h2H2,1H3,(H,8,10)
InChI Key:
SVKLVMZLIIMJID-UHFFFAOYSA-N
SMILES:
O=C1NC(=C(C(=O)C1)I)C
Properties
Complexity:
232
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.944g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
251.023g/mol
Monoisotopic Mass:
250.944g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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