Dibenzothiophene, 2-bromo-


Chemical Name: Dibenzothiophene, 2-bromo-
CAS Number: 22439-61-8
Product Number: AG0037SL(AGN-PC-0JPHAK)
Synonyms:
MDL No: MFCD00089285
Molecular Formula: C12H7BrS
Molecular Weight: 263.1530

Identification/Properties


Computed Properties
Molecular Weight:
263.152g/mol
XLogP3:
5.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
0
Exact Mass:
261.945g/mol
Monoisotopic Mass:
261.945g/mol
Topological Polar Surface Area:
28.2A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
218
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#:
N/A
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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