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14959-34-3 | Pyridazine, 3-bromo-6-phenyl-
CAS No: 14959-34-3 Catalog No: AG001LUI MDL No:
Product Description
Catalog Number:
AG001LUI
Chemical Name:
Pyridazine, 3-bromo-6-phenyl-
CAS Number:
14959-34-3
Molecular Formula:
C10H7BrN2
Molecular Weight:
235.0800
IUPAC Name:
3-bromo-6-phenylpyridazine
InChI:
InChI=1S/C10H7BrN2/c11-10-7-6-9(12-13-10)8-4-2-1-3-5-8/h1-7H
InChI Key:
BOZFKAFYPNJUKU-UHFFFAOYSA-N
SMILES:
Brc1ccc(nn1)c1ccccc1
Properties
Complexity:
157
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.979g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
235.084g/mol
Monoisotopic Mass:
233.979g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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