1-(2-Chloro-4-hydroxyphenyl)ethanone
-
1-(2-Chloro-4-hydroxyphenyl)ethanone
structure -
-
CAS No:
68301-59-7
-
Formula:
C8H7ClO2
-
Chemical Name:
1-(2-Chloro-4-hydroxyphenyl)ethanone
-
Synonyms:
Ethanone,1-(2-chloro-4-hydroxyphenyl)-;1-(2-Chloro-4-hydroxyphenyl)ethanone;2′-Chloro-4′-hydroxyacetophenone;3-Chloro-4-acetylphenol;1-(2-Chloro-4-hydroxyphenyl)ethan-1-one
-
CAS No:
Safety Information
Xi
Irritant
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
H302
|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.
1-(2-Chloro-4-hydroxyphenyl)ethanone Use and Manufacturing
To a solution of l-(2-chloro-4-hydroxyphenyl) ethan- 1-one (150 mg, 0.88 mmol), Compound INT-001 (250 mg, 0.87 mmol) andtriphenylphosphane (346 mg, 1.32 mmol) in tetrahydrofuran (5 mL) was added DIAD (267 mg, 1.32 mmol) dropwise at 0C. The resulting solution was allowed warm to roomtemperature and stirred for another 2 h. The resulting mixture was concentrated under vacuum. The residue was applied onto a silica gel column with ethyl acetate/petroleum ether (1 : 10). This resulted in 300 mg (78%) of the title compound as a white solid. LC-MS (ESI, m/z):[M+H]+= 438.0, 440.0.
Computed Properties
Molecular Weight:170.59
XLogP3:2.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:170.0134572
Monoisotopic Mass:170.0134572
Topological Polar Surface Area:37.3
Heavy Atom Count:11
Complexity:158
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
1-(2-Chloro-4-hydroxyphenyl)ethanone
SDSRequest for Quotation