5-FLUORO-M-XYLENE
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5-FLUORO-M-XYLENE
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CAS No:
461-97-2
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Formula:
C8H9F
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Chemical Name:
5-FLUORO-M-XYLENE
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Synonyms:
Fluoroxylene4;5-FLUORO-M-XYLENE;5-Fluoro-m-xylene,97%;3,5-DIMETHYLFLUOROBENZENE;1-FLUORO-3,5-DIMETHYLBENZENE;1,3-dimethyl-5-fluorobenzene;3,5-Dimethylfluorobenzene98%;3,5-Dimethylfluorobenzene98%;1,3-Dimethyl-5-fluorobenzene98%;5-Fluoro-m-xylene,1,3-Dimethyl-5-fluoroBenzene
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CAS No:
Safety Information
Ⅲ
3
1993
3
S16-S33-S36/37/39-S26-S23
Xi:Irritant;
P210, P233, P240, P241, P242, P243, P261, P264, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P370+P378, P403+P233, P403+P235, P405, P501
H225
|Danger|H225 (14.29%): Highly Flammable liquid and vapor [Danger Flammable liquids]|P210, P233, P240, P241, P242, P243, P261, P264, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P370+P378, P403+P233, P403+P235, P405, and P501|Aggregated GHS information provided by 7 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
5-FLUORO-M-XYLENE Use and Manufacturing
General procedure: 14 Typical continuous diazotization procedure: Material A (50 mL of aqueous solution containing amine (100 mmol), fluoroboric acid (120 mmol), hydrochloric acid (180 mmol)), and material B (50 mL of aqueous solution containing sodium nitrite (105 mmol)) were pumped into the T-joint at 4 mL/min, respectively, after a residence time of about 15 s at 25 °C in a reacting tube, the mixture flowed through the outlet and accumulated in the cooling vessel. Vigorous stirring was maintained. The solid was filtered with suction after the slurry was cooled to −5 °C. The solid was washed with methanol and then dried in vacuo to yield the corresponding diazonium tetrafluoroborate. 15 Typical continuous fluorodediazoniation procedure: Slurry of the diazonium tetrafluoroborate prepared as above in 300 mL of cosolvent was introduced into a reacting tube continuously at a flow rate of 4 mL/min. The mixture was maintained for 1 min at setting temperature and then cooled in the tandem tube. The collected liquid was washed with aqueous NaOH and water, nearly colorless liquid was obtained.General procedure: To an oven-dried 4 mL vial was added arene (0.1 mmol, 1.0 equiv), and 0.2 mL of a stock solution containing 0.1 molpercent [Ir(COD)OMe]2, 0.2 molpercent 4, 4'-di-tert-butyl bipyridine (dtbpy), and 0.75 equiv of B2P i2. The vial was sealed with a Teflon-lined cap and heated at 80 °C for 18 h. The solution was allowed to cool, and the volatile components were removed in vacuo. To the crude ArBPin was added AgF (25 mg, 0.2 mmol, 2.0 equiv), ('BuCN^CuOTf (76 mg, 0.2 mmol, 2.0 equiv), Me
Computed Properties
Molecular Weight:124.15
XLogP3:2.8
Hydrogen Bond Acceptor Count:1
Exact Mass:124.068828449
Monoisotopic Mass:124.068828449
Heavy Atom Count:9
Complexity:80.6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes