Benzene, 1-azido-3-bromo-


Chemical Name: Benzene, 1-azido-3-bromo-
CAS Number: 2101-89-5
Product Number: AG002KKR(AGN-PC-0JSWM6)
Synonyms:
MDL No:
Molecular Formula: C6H4BrN3
Molecular Weight: 198.0201

Identification/Properties


Computed Properties
Molecular Weight:
198.023g/mol
XLogP3:
3.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
196.959g/mol
Monoisotopic Mass:
196.959g/mol
Topological Polar Surface Area:
14.4A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
153
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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