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Home > Bromides > 1227607-98-8
1227607-98-8 | 4(3H)-Pyridazinone, 5,6-dibromo-3-phenyl-
CAS No: 1227607-98-8 Catalog No: AG000JEG MDL No:
Product Description
Catalog Number:
AG000JEG
Chemical Name:
4(3H)-Pyridazinone, 5,6-dibromo-3-phenyl-
CAS Number:
1227607-98-8
Molecular Formula:
C10H6Br2N2O
Molecular Weight:
329.9754
IUPAC Name:
5,6-dibromo-3-phenyl-3H-pyridazin-4-one
InChI:
InChI=1S/C10H6Br2N2O/c11-7-9(15)8(13-14-10(7)12)6-4-2-1-3-5-6/h1-5,8H
InChI Key:
VFSFZYNKDCMHQB-UHFFFAOYSA-N
SMILES:
O=C1C(=C(Br)N=NC1c1ccccc1)Br
Properties
Complexity:
332
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
329.883g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
329.979g/mol
Monoisotopic Mass:
327.885g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
41.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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