5-Bromo-1,6-dimethyl-1H-indazole


Chemical Name: 5-Bromo-1,6-dimethyl-1H-indazole
CAS Number: 1159511-81-5
Product Number: AG000H62(AGN-PC-0WB2I1)
Synonyms:
MDL No: MFCD12028625
Molecular Formula: C9H9BrN2
Molecular Weight: 225.0852

Identification/Properties


Computed Properties
Molecular Weight:
225.089g/mol
XLogP3:
2.6
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
0
Exact Mass:
223.995g/mol
Monoisotopic Mass:
223.995g/mol
Topological Polar Surface Area:
17.8A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
174
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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