3,4,3',4'-Tetrachloroazoxybenzene supplier

Name
3,3',4,4'-TETRACHLOROAZOXYBENZENE
EINECS
CAS No. 21232-47-3
Article Data12
CAS DataBase
Density 1.53 g/cm³
Solubility
Melting Point
Formula C₁₂H₆Cl₄N₂O
Boiling Point 472.7 °C at 760 mmHg
Molecular Weight 336.004
Flash Point 239.7 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms TCAOB;3,4,3,4-Tetrachloroazoxybenzene;Azoxybenzene, 3,3,4,4-tetrachloro-;(3,4-dichlorophenyl)-(3,4-dichlorophenyl)imino-oxido-azanium;Diazene, bis(3,4-dichlorophenyl)-, 1-oxide (9CI);3,3,4,4-TETRACHLOROAZOXYBENZENE;Bis(3,4-dichlorophenyl)diazene 1-oxide;BIS(3,4-DICHLOROPHENYL)-DIAZENE 1-OXIDE (9CI);
PSA 41.11000
LogP 6.74910

3,4,3',4'-Tetrachloroazoxybenzene Specification

This chemical is called 3,4,3',4'-Tetrachloroazoxybenzene, and its IUPAC name is (3,4-dichlorophenyl)-(3,4-dichlorophenyl)imino-oxidoazanium. With the molecular formula of C₁₂H₆Cl₄N₂O, its molecular weight is 336.00. The CAS registry number of this chemical is 21232-47-3, and its classification codes are Mutation data; Reproductive Effect.

Other characteristics of the 3,4,3',4'-Tetrachloroazoxybenzene can be summarised as followings: (1)ACD/LogP: 6.59; (2)# of Rule of 5 Violations: 1 ; (3)#H bond acceptors: 3; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 41.11 Å²; (7)Index of Refraction: 1.641; (8)Molar Refractivity: 79.01 cm³; (9)Molar Volume: 218.8 cm³; (10)Polarizability: 31.32×10^-24cm³; (11)Surface Tension: 50.3 dyne/cm; (12)Density: 1.53 g/cm³; (13)Flash Point: 239.7 °C; (14)Enthalpy of Vaporization: 70.76 kJ/mol; (15)Boiling Point: 472.7 °C at 760 mmHg; (16)Vapour Pressure: 1.19E-08 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: Clc2ccc(\N=[N+](/[O-])c1ccc(Cl)c(Cl)c1)cc2Cl
2.InChI: InChI=1/C12H6Cl4N2O/c13-9-3-1-7(5-11(9)15)17-18(19)8-2-4-10(14)12(16)6-8/h1-6H/b18-17-
3.InChIKey: BCOVXBPXQLIGEV-ZCXUNETKBY

The toxicity data is as follows:

cyt-mus-orl 134 mg/kg/4W-C

AECTCV Archives of Environmental Contamination and Toxicology. 14 (1985),677.

Product Name

3,3',4,4'-TETRACHLOROAZOXYBENZENE

3,4,3',4'-Tetrachloroazoxybenzene Specification

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