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825634-21-7 | 3(2H)-Pyridazinone, 4,5-diiodo-2-methyl-
CAS No: 825634-21-7 Catalog No: AG0053NS MDL No:MFCD28024035
Product Description
Catalog Number:
AG0053NS
Chemical Name:
3(2H)-Pyridazinone, 4,5-diiodo-2-methyl-
CAS Number:
825634-21-7
Molecular Formula:
C5H4I2N2O
Molecular Weight:
361.9070
MDL Number:
MFCD28024035
IUPAC Name:
4,5-diiodo-2-methylpyridazin-3-one
InChI:
InChI=1S/C5H4I2N2O/c1-9-5(10)4(7)3(6)2-8-9/h2H,1H3
InChI Key:
IYPWPMLVROBDLH-UHFFFAOYSA-N
SMILES:
Cn1ncc(c(c1=O)I)I
Properties
Complexity:
234
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
361.841g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
361.909g/mol
Monoisotopic Mass:
361.841g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
32.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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