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5-CHLORO-2-IODOPHENOL

5-CHLORO-2-IODOPHENOL structure

CAS No:
136808-72-5
Formula:
C6H4ClIO
Chemical Name:
5-CHLORO-2-IODOPHENOL
Synonyms:
5-chloro-2-iodophenol;Phenol, 5-chloro-2-iodo-;Phenol,5-chloro-2-iodo-;2-iodo-5-chlorophenol;ICCB4_000164;PubChem9582;ACMC-209wsq;5-Chloro-2-iodo-phenol;CBiol_000868;5-chloranyl-2-iodanyl-phenol
Categories:
Chemical Reagents > Organic Reagents

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5-CHLORO-2-IODOPHENOL Basic Attributes

Molecular Weight：

254.46

Exact Mass：

253.899521

DSSTox ID：

DTXSID80425050

HScode：

2908199090

Characteristics

PSA：

20.2

XLogP3：

2.9

Density：

2.087

Boiling Point：

219℃

Flash Point：

86℃

Refractive Index：

1.678

Vapor Pressure：

0.0832mmHg at 25°C

Safety Information

Precautionary statement(s)：

P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, P501

Hazard Statements：

H302

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

5-CHLORO-2-IODOPHENOL Use and Manufacturing

Intermediate 15-Chloro-2-iodo-phenol 2-Amino-5-chlorophenol (5.7 g, 40 mmol) is dissolved in DMSO/water/HIntermediate 15-Chloro-2-iodo-phenol 2-Amino-5-chlorophenol (5.7 g, 40 mmol) is dissolved in DMSO/water/H2SO4 (200/60/140 mL) and cooled to 0 C. To this solution is added sodium nitrite (4.1 g, 60 mmol) in water (20 mL) and the mixture is stirred for 1 h at 0 C. To the mixture is added potassium iodide (19.9 g, 120 mmol) in water (20 mL) and the mixture is stirred at room temperature for 1 h. Another batch of potassium iodide (19.9 g, 120 mmol) in water (20 mL) is added and the mixture is stirred at room temperature for 1 h. The mixture is diluted with ethyl acetate, washed with water, saturated aqueous sodium sulfate, and brine. The organic portion is dried over MgSO4, filtered, and concentrated under reduced pressure. The resulting residue is purified by flash chromatography (Biotage Si65M, 20% ethyl acetate/hexane) to yield 8.09 g (79%) of the title compound as a pink solid. GCMS m/e 254 [M]-.To a solution of To a solution of

Computed Properties

Molecular Weight:254.45
XLogP3:2.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Exact Mass:253.89954
Monoisotopic Mass:253.89954
Topological Polar Surface Area:20.2
Heavy Atom Count:9
Complexity:99.1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Recommended Suppliers of 5-CHLORO-2-IODOPHENOL

Compound Net Biotechnology Inc. Contact Supplier

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136808-72-5 5-chloro-2-iodophenol

CAS No.: 136808-72-5

Grade: Industrial Grade

Content: 95%

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