CAS No.116272-42-5,5-CHLORO-2-FLUOROIODOBENZENE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	116272-42-5
Name:	5-CHLORO-2-FLUOROIODOBENZENE
Article Data:	1

Formula:	C₆H₃ClFI
Molecular Weight:	256.446
Synonyms:	4-Chloro-1-fluoro-2-iodobenzene;5-Chloro-2-fluoroiodobenzene;
Density:	2.008 g/cm³
Boiling Point:	226.3 °C at 760 mmHg
Flash Point:	90.7 °C
Hazard Symbols:	Xi
Risk Codes:	36/37/38
Safety:	26-36
PSA:	0.00000
LogP:	3.08370

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Specification

The 5-Chloro-2-fluoroiodobenzene, with the CAS registry number 116272-42-5, is also known as 4-Chloro-1-fluoro-2-iodobenzene. This chemical's molecular formula is C₆H₃ClFI and molecular weight is 256.44. Its systematic name is called 4-chloro-1-fluoro-2-iodobenzene.

Physical properties about this chemical are: (1)ACD/LogP: 3.30; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.3; (4)ACD/LogD (pH 7.4): 3.3; (5)ACD/BCF (pH 5.5): 191.12; (6)ACD/BCF (pH 7.4): 191.12; (7)ACD/KOC (pH 5.5): 1494.75; (8)ACD/KOC (pH 7.4): 1494.75; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Index of Refraction: 1.606; (13)Molar Refractivity: 44.04 cm³; (14)Molar Volume: 127.6 cm³; (15)Surface Tension: 42.4 dyne/cm; (16)Density: 2.008 g/cm³; (17)Flash Point: 90.7 °C; (18) Enthalpy of Vaporization: 44.4 kJ/mol; (19)Boiling Point: 226.3 °C at 760 mmHg; (20)Vapour Pressure: 0.124 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical may cause inflammation to the skin or other mucous membranes. It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you will contact it, please wear suitable protective clothing.

You can still convert the following datas into molecular structure:
(1)SMILES: Fc1ccc(Cl)cc1I
(2)InChI: InChI=1/C6H3ClFI/c7-4-1-2-5(8)6(9)3-4/h1-3H
(3)InChIKey: CNJQPBYTHITJAO-UHFFFAOYAT