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2,5-Dichlorofluorobenzene

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Name

2,5-Dichlorofluorobenzene

EINECS N/A
CAS No. 348-59-4 Density 1.403 g/cm3
PSA 0.00000 LogP 3.13250
Solubility N/A Melting Point 4 °C
Formula C6H3Cl2F Boiling Point 170.6 °C at 760 mmHg
Molecular Weight 164.994 Flash Point 58.1 °C
Transport Information UN 1992 Appearance clear colorless liquid
Safety 37/39-26 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 348-59-4 (2,5-DICHLOROFLUOROBENZENE) Hazard Symbols IrritantXi
Synonyms

1,4-Dichloro-2-fluorobenzene;1-Fluoro-2,5-dichlorobenzene;2,5-Dichloro-1-fluorobenzene;2,5-Dichlorofluorobenzene;NSC 10256;

Article Data 2

2,5-Dichlorofluorobenzene Specification

The 2,5-Dichlorofluorobenzene with cas registry number of 348-59-4 belongs to several categories: Other fluorin-contained compounds; Chlorine Compounds; Fluorine Compounds. Both its systematic name and IUPAC name are the same which is called 1,4-dichloro-2-fluorobenzene. It is clear colorless liquid.

The physical properties about this chemical are: (1)ACD/LogP: 3.06; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.06; (4)ACD/LogD (pH 7.4): 3.06; (5)ACD/BCF (pH 5.5): 123.7; (6)ACD/BCF (pH 7.4): 123.7; (7)ACD/KOC (pH 5.5): 1094.8; (8)ACD/KOC (pH 7.4): 1094.8; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Index of Refraction: 1.525; (13)Molar Refractivity: 36.03 cm3; (14)Molar Volume: 117.5 cm3; (15)Surface Tension: 35.1 dyne/cm; (16)Density: 1.403 g/cm3; (17)Flash Point: 58.1 °C; (18)Enthalpy of Vaporization: 39.02 kJ/mol; (19)Boiling Point: 170.6 °C at 760 mmHg; (20)Vapour Pressure: 1.94 mmHg at 25°C ; (21)Refractive index: 1.5235-1.5255.

Uses of 2,5-Dichlorofluorobenzene: it can be used to produce other chemicals. Here is an example. It can react with reagent AgF2 and solvent hexane for 18 hours to produce 1-chloro-4-fluoro-benzene; 4-chloro-1,2-difluoro-benzene; 1,4-dichloro-2-fluoro-benzene; 3,3,6,6-tetrafluoro-1,4-cyclohexadiene and 1,4-dichloro-3,3,6-trifluoro-1,4-cyclohexadiene.

When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system. Therefore, wear suitable protective clothing, gloves and eye/face protection during using it. In case of contact with eyes, rinse immediately with
plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc1ccc(Cl)c(F)c1;
(2)InChI: InChI=1/C6H3Cl2F/c7-4-1-2-5(8)6(9)3-4/h1-3H;
(3)InChIKey: BJQTYCQGIXZSNM-UHFFFAOYAX

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