CAS No.202865-73-4,2-BROMO-4-FLUORO-1-IODOBENZENE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	202865-73-4
Name:	2-BROMO-4-FLUORO-1-IODOBENZENE
Article Data:	2

Formula:	C₆H₃BrFI
Molecular Weight:	300.897
Synonyms:	2-Bromo-4-fluoro-1-iodobenzene;2-Bromo-4-fluoroiodobenzene;
EINECS:	-0
Density:	2.281 g/cm³
Boiling Point:	243.2 °C at 760 mmHg
Flash Point:	100.9 °C
Solubility:	Not miscible or difficult to mix in water.
Appearance:	Clear colourless to light yellow liquid
Hazard Symbols:	Xi
Risk Codes:	36/37/38
Safety:	26-36/37
PSA:	0.00000
LogP:	3.19280

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Specification

The systematic name of 2-Bromo-4-fluoroiodobenzene is 2-bromo-4-fluoro-1-iodobenzene. With the CAS registry number 202865-73-4, it is also named as Benzene, 2-bromo-4-fluoro-1-iodo-. The product's categories are Aromatic Halides (substituted); Bromine Compounds; Fluorine Compounds; Iodine Compounds; Aryl; C6; Halogenated Hydrocarbons. It is clear colourless to light yellow liquid which is sensitive to light. Additionally, this chemical should be sealed in the container and stored in the ventilate and dry place.

The other characteristics of 2-Bromo-4-fluoroiodobenzene can be summarized as: (1)ACD/LogP: 3.91; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.91; (4)ACD/LogD (pH 7.4): 3.91; (5)ACD/BCF (pH 5.5): 547.3; (6)ACD/BCF (pH 7.4): 547.3; (7)ACD/KOC (pH 5.5): 3174.12; (8)ACD/KOC (pH 7.4): 3174.12; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Index of Refraction: 1.628; (13)Molar Refractivity: 46.84 cm³; (14)Molar Volume: 131.9 cm³; (15)Polarizability: 18.57×10^-24 cm³; (16)Surface Tension: 44.4 dyne/cm ; (17)Flash Point: 100.9 °C; (18)Enthalpy of Vaporization: 46.07 kJ/mol; (19)Boiling Point: 243.2 °C at 760 mmHg; (20)Vapour Pressure: 0.0507 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
It is irritating to eyes, respiratory system and skin. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. If you want to contact this product, you must wear suitable protective clothing and gloves.

People can use the following data to convert to the molecule structure.
1. SMILES:Fc1cc(Br)c(I)cc1
2. InChI:InChI=1/C6H3BrFI/c7-5-3-4(8)1-2-6(5)9/h1-3H
3. InChIKey:GKGPZAZTXZCUMU-UHFFFAOYAL