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4-Fluoroisoquinoline

4-Fluoroisoquinoline structure

CAS No:
394-67-2
Formula:
C9H6FN
Chemical Name:
4-Fluoroisoquinoline
Synonyms:
4-fluoroisoquinoline;isoquinoline, 4-fluoro-;4-Fluoro-isoquinoline;4-fluoranylisoquinoline;SCHEMBL998807;CTK1C1994;KS-00000DJU;DTXSID80348836;MFCD06656128;ZINC14989389
Categories:
Pharmaceutical Intermediates > Ophthalmic Agents

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4-Fluoroisoquinoline Basic Attributes

Molecular Weight：

147.15

Exact Mass：

147.048431

DSSTox ID：

DTXSID80348836

HScode：

2933499090

Characteristics

PSA：

12.9

XLogP3：

2.2

Density：

1.216

Boiling Point：

240℃

Flash Point：

99℃

Refractive Index：

1.5914

Safety Information

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, and P362|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

4-Fluoroisoquinoline Use and Manufacturing

To a solution of n-butyl lithium (133 mL, 332.5 mmol, 2.5 M in THF) in 760 mL THF was added a solution of 4-bromoisoquinoline 24a (20 g, 96.6 mmol) in 144 mL THF dropwise at -65° C. and the resulting mixture was stirred at this temperature for another 30 mm after the completion of addition. To a solution of n-butyl lithium (133 mL, 332.5 mmol, 2.5 M in THF) in 760 mL THF was added a solution of 4-bromoisoquinoline 24a (20 g, 96.6 mmol) in 144 mL THF dropwise at -65° C. and the resulting mixture was stirred at this temperature for another 30 mm after the completion of addition. Production of 4-fluoroisoquinoline-5-sulfonyl chloride hydrochloride from 4-fluoroisoquinoline To a 10-L-capacity reactor equipped with a stirrer, a thermometer, a condenser, and a dropper, 4-fluoroisoquinoline (750.0 g, 5.1 mol) which has been produced according to the method disclosed in the pamphlet of1-Chloro-1-chloro-

Computed Properties

Molecular Weight:147.15
XLogP3:2.2
Hydrogen Bond Acceptor Count:2
Exact Mass:147.048427358
Monoisotopic Mass:147.048427358
Topological Polar Surface Area:12.9
Heavy Atom Count:11
Complexity:138
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Recommended Suppliers of 4-Fluoroisoquinoline

Shaanxi Dideu Medichem Co. Ltd Contact Supplier

CN
5 YRS

Business licensed Certified factory

Manufactory Supplier of Chemical Pesticides,Food Additives,Agrochemicals,Active Pharm Ingredients,Flavors and Fragrances,Chemical Catalyst,Chemical Materials,Chem&Pharm Intermediates,Organic Intermediates,Feed Additive

Isoquinoline, 4-fluoro-

CAS No.: 394-67-2

Content: 99%

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Hangzhou Royalchem Co.,LTD Contact Supplier

CN
2 YRS

Business licensed

Trader Supplier of Pharmaceutical intermediates

4-Fluoroisoquinoline RC06329

Unit Price: $1 /KG EXW

CAS No.: 394-67-2

Grade: Industrial Grade

Content: 99%

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