3,5,6,8-Tetrabromo-1,10-phenanthroline
Catalog Number
ACM66127002-2
CAS
66127-00-2
IUPAC Name
3,5,6,8-tetrabromo-1,10-phenanthroline
Synonyms
66127-00-2; CTK1I0855; 3,5,6,8-tetrabromo-1,10-phenanthroline; BAPJVWLAFSQLNX-UHFFFAOYSA-N; 1,10-Phenanthroline, 3,5,6,8-tetrabromo-; ACMC-1B8M0; SCHEMBL7059861;
Application
3,5,6,8-Tetrabromo-1,10-phenanthroline can be used in the nickel-catalyzed amination of aryl and heteroaryl chlorides.
Molecular Weight
495.79
Molecular Formula
C12H4Br4N2
Product Information
Canonical SMILES
C1=C(C=NC2=C1C(=C(C3=C2N=CC(=C3)Br)Br)Br)Br
InChI
BAPJVWLAFSQLNX-UHFFFAOYSA-N
InChI Key
InChI=1S/C12H4Br4N2/c13-5-1-7-9(15)10(16)8-2-6(14)4-18-12(8)11(7)17-3-5/h1-4H
Boiling Point
523.2±45.0 °C(Predicted)
Melting Point
356°C-lit.
Purity
98%
Appearance
White powder
Complexity
287
Exact Mass
495.70670
Hazard Statements
H413 : May cause long lasting harmful effects to aquatic life.
Heavy Atom Count
18
Hydrogen Bond Acceptor Count
2
Hydrogen Bond Donor Count
0
MDL Number
MFCD09879848
Monoisotopic Mass
491.71080
Precautionary Statements
P501 : Dispose of contents/ container to an approved waste disposal plant.P273 : Avoid release to the environment.
Reaxys Registry Number
246316
Rotatable Bond Count
0
Topological Polar Surface Area
25.8 Ų
Please kindly note that our products and services are for research use only.
Have a question? Get a Free Consultation