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Benzene,1,1'-sulfonylbis[4-bromo- (2050-48-8)

Identification
Name:Benzene,1,1'-sulfonylbis[4-bromo-
Synonyms:Sulfone,bis(p-bromophenyl) (6CI,7CI,8CI);1,1'-Sulfonylbis[4-bromobenzene];4,4'-Dibromodiphenyl sulfone;Bis(4-bromophenyl) sulfone;Bis(p-bromophenyl)sulfone;NSC 43047;
CAS:2050-48-8
Molecular Formula: C12H8Br2O2S
Molecular Weight: 376.06
InChI: InChI=1/C12H8Br2O2S/c13-9-1-5-11(6-2-9)17(15,16)12-7-3-10(14)4-8-12/h1-8H
Molecular Structure: (C12H8Br2O2S) Sulfone,bis(p-bromophenyl) (6CI,7CI,8CI);1,1'-Sulfonylbis[4-bromobenzene];4,4'-Dibromodiphenyl sulfo...
Properties
Flash Point: 229.4°C
Boiling Point: 455.7°Cat760mmHg
Density:1.789g/cm3
Refractive index:1.64
Specification:

The 4,4'-Dibromodiphenylsulfone with its cas register number is 2050-48-8. It also can be called as Bis(4-bromophenyl)sulfone and the IUPAC Name about this chemical is 1-bromo-4-(4-bromophenyl)sulfonylbenzene.

Physical properties about 1-Aminoindan sulfate are: (1)ACD/LogP: 4.76; (2)ACD/LogD (pH 5.5): 4.76; (3)ACD/LogD (pH 7.4): 4.76; (4)ACD/BCF (pH 5.5): 2458.58; (5)ACD/BCF (pH 7.4): 2458.58; (6)ACD/KOC (pH 5.5): 9303.53; (7)ACD/KOC (pH 7.4): 9303.53; (8)#H bond acceptors: 2; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 42.52Å2; (11)Index of Refraction: 1.64; (12)Molar Refractivity: 75.72 cm3; (13)Molar Volume: 210.1 cm3; (14)Polarizability: 30.01x10-24cm3; (15)Surface Tension: 50.1 dyne/cm; (16)Enthalpy of Vaporization: 68.8 kJ/mol; (17)Vapour Pressure: 4.65E-08 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC(=CC=C1S(=O)(=O)C2=CC=C(C=C2)Br)Br
(2)InChI: InChI=1S/C12H8Br2O2S/c13-9-1-5-11(6-2-9)17(15,16)12-7-3-10(14)4-8-12/h1-8H
(3)InChIKey: QBNABJXQGRVIRA-UHFFFAOYSA-N

The toxicity data is as follows:

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 320mg/kg (320mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#01239,

Flash Point: 229.4°C
Safety Data
 

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