Phenol, 4,4'-(1,1-dioxido-3H-2,1-benzoxathiol-3-ylidene)bis[2-bromo-


Chemical Name: Phenol, 4,4'-(1,1-dioxido-3H-2,1-benzoxathiol-3-ylidene)bis[2-bromo-
CAS Number: 2800-80-8
Product Number: AG00BBYI(AGN-PC-0JLPRC)
Synonyms:
MDL No:
Molecular Formula: C19H12Br2O5S
Molecular Weight: 512.1686

Identification/Properties


Properties
BP:
586.8°C at 760 mmHg
Storage:
Room Temperature;
Computed Properties
Molecular Weight:
512.168g/mol
XLogP3:
4.4
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
2
Exact Mass:
511.875g/mol
Monoisotopic Mass:
509.877g/mol
Topological Polar Surface Area:
92.2A^2
Heavy Atom Count:
27
Formal Charge:
0
Complexity:
625
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:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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