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825633-94-1

825633-94-1 | 5-Iodopyridazin-3(2H)-one

CAS No: 825633-94-1 Catalog No: AG0038F3 MDL No:MFCD08693620

Product Description

Catalog Number:
AG0038F3
Chemical Name:
5-Iodopyridazin-3(2H)-one
CAS Number:
825633-94-1
Molecular Formula:
C4H3IN2O
Molecular Weight:
221.9839
MDL Number:
MFCD08693620
IUPAC Name:
4-iodo-1H-pyridazin-6-one
InChI:
InChI=1S/C4H3IN2O/c5-3-1-4(8)7-6-2-3/h1-2H,(H,7,8)
InChI Key:
UZWMMCWOUBWROK-UHFFFAOYSA-N
SMILES:
Ic1cc(=O)[nH]nc1

Properties

Complexity:
173  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.929g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
221.985g/mol
Monoisotopic Mass:
221.929g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
41.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1  

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