5-Chloro-2-iodobenzenamine
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5-Chloro-2-iodobenzenamine
structure -
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CAS No:
6828-35-9
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Formula:
C6H5ClIN
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Chemical Name:
5-Chloro-2-iodobenzenamine
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Synonyms:
Benzenamine,5-chloro-2-iodo-;Aniline,5-chloro-2-iodo-;5-Chloro-2-iodobenzenamine;5-Chloro-2-iodoaniline;3-Chloro-6-iodoaniline
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CAS No:
Characteristics
26
2.5
2.0±0.1 g/cm3
64-66 °C @ Solvent: Diethyl ether, Heptane
295.8°C at 760 mmHg
110 °C
1.694
Safety Information
Ⅲ
6.1
UN2811
3
25-37/38-41-52/53
26-36/37/39-45-61
Xi,T
Irritant
P261-P280-P301 + P310-P305 + P351 + P338
H301-H315-H318-H335
|Danger|H301 (88.89%): Toxic if swallowed [Danger Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P310, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P310, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 45 companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
5-Chloro-2-iodobenzenamine Use and Manufacturing
A typical procedure was followed for one-pot synthesis of substituted 2-iodoaniline and 2-iodoacetanilide from substituted aniline. A mixture of 5 g of substituted aniline 1–6 shown inTable 1, granulated iodine (1 mol. equiv.) and copper(II) acetate(1 mol. equiv.) were stirred in 50 mL of glacial acetic for 30 min.The reaction mixture was refluxed for 12 h with constant stirring at 120 C. Then the reaction mixture was allowed to cool at room temperature. The precipitate of copper(I) iodide was removed byfiltration and the filtrate was poured into water and extracted with chloroform (3 50 mL). The combined chloroform extracts were washed with sodium hydrogen carbonate solution, sodium thiosulfate solution, distilled water and dried with anhydrous sodium sulfate.A crude semi-solid mass was obtained after removal of solvent. The crude product was purified by column chromatographyon silica gel using n-hexane/ethyl acetate as eluant (4:1) and compounds 7–24 were isolated.
Computed Properties
Molecular Weight:253.47
XLogP3:2.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Exact Mass:252.91552
Monoisotopic Mass:252.91552
Topological Polar Surface Area:26
Heavy Atom Count:9
Complexity:99.1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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