2,5-Cyclohexadien-1-one, 2,6-dibromo-4-(chloroimino)-


Chemical Name: 2,5-Cyclohexadien-1-one, 2,6-dibromo-4-(chloroimino)-
CAS Number: 537-45-1
Product Number: AG003G2K(AGN-PC-0JK9Q9)
Synonyms:
MDL No:
Molecular Formula: C6H2Br2ClNO
Molecular Weight: 299.3472

Identification/Properties


Properties
MP:
76-84 °C
BP:
295.9°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Refractive Index:
1.6110 (estimate)
Computed Properties
Molecular Weight:
299.346g/mol
XLogP3:
3.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
298.817g/mol
Monoisotopic Mass:
296.819g/mol
Topological Polar Surface Area:
29.4A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
269
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

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H312+H332-H315-H319
Precautionary Statements:
P261-P264-P271-P280-P302+P352+P312+P362+P364-P304+P340+P312-P305+P351+P338+P337+P313-P501
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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