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Home > Bromides > 1159818-53-7
1159818-53-7 | Pyridazine, 3-bromo-6-(3-pyridinyl)-
CAS No: 1159818-53-7 Catalog No: AG000HAF MDL No:MFCD12032765
Product Description
Catalog Number:
AG000HAF
Chemical Name:
Pyridazine, 3-bromo-6-(3-pyridinyl)-
CAS Number:
1159818-53-7
Molecular Formula:
C9H6BrN3
Molecular Weight:
236.0680
MDL Number:
MFCD12032765
IUPAC Name:
3-bromo-6-pyridin-3-ylpyridazine
InChI:
InChI=1S/C9H6BrN3/c10-9-4-3-8(12-13-9)7-2-1-5-11-6-7/h1-6H
InChI Key:
QKBBEDNMZSDEPW-UHFFFAOYSA-N
SMILES:
Brc1ccc(nn1)c1cccnc1
Properties
Complexity:
165
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.975g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
236.072g/mol
Monoisotopic Mass:
234.975g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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