4-(4-Chlorophenoxy)phenol
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4-(4-Chlorophenoxy)phenol
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CAS No:
21567-18-0
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Formula:
C12H9ClO2
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Chemical Name:
4-(4-Chlorophenoxy)phenol
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Synonyms:
4-(4-Chlorophenoxy)phenol;4-(4-CHLOROPHENOXY)PHENOL,99.5%;4-Hydroxy-4-chloro-diphenylether;4-(4-Chlorophenyloxy)phenol;4-Chloro-4'-hydroxydiphenyl ether;p-(p-Chlorophenoxy)phenol;4-(4-Chlorophenoxy)
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CAS No:
4-(4-Chlorophenoxy)phenol Basic Attributes
220.65
220.029114
1312995-182-4
DTXSID30492772
2909500000
Safety Information
NONH for all modes of transport
3
22-41-43
26-36/37/39
Xn
P261-P280-P305 + P351 + P338-P342 + P311
H302-H318-H334
|Danger|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P280, P285, P301+P312, P304+P341, P305+P351+P338, P310, P330, P342+P311, and P501|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
4-(4-Chlorophenoxy)phenol Use and Manufacturing
Step 2; 4-(4-chloro-phenoxy)-phenol; Following the general procedure for (step 2), boron tribromide (1.0 M solution in dichloromethane, 9.66 mL, 9.66 mmol) was added to the product from step 1 (0.76 g, 3.22 mmol) in dichloromethane (15 mL) to afford the title compound (0.37 g, 52percent) as a light-green solid.; Step 2; 4-(4-Chloro-phenoxy)-phenol; To a solution of the product from step 1 (2.86 g, 12.18 mmol) in dichloromethane (50 mL) at -78° C. was added boron tribromide (1.0 M solution in dichloromethane, 30 mL, 30.5 mmol) dropwise over 5 min. The subsequent mixture was stirred at -78° C. for an hour followed by ambient temperature for an hour. After cooling the reaction mixture to 0° C., it was slowly added to cold water/dichloromethane (50 mL/50 mL). The organic portion was washed with water, brine, dried over anhydrous Na
Computed Properties
Molecular Weight:220.65
XLogP3:4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:220.0291072
Monoisotopic Mass:220.0291072
Topological Polar Surface Area:29.5
Heavy Atom Count:15
Complexity:182
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes