2-(4-(adaMantan-1-yl)phenoxy)acetic acid
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2-(4-(adaMantan-1-yl)phenoxy)acetic acid
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CAS No:
52804-26-9
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Formula:
C18H22O3
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Chemical Name:
2-(4-(adaMantan-1-yl)phenoxy)acetic acid
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Synonyms:
2-(4-(adaMantan-1-yl)phenoxy)acetic acid;(4-AdaMantan-1-yl-phenoxy)-aceticacid;(4-Tricyclo[3.3.1.1(3,7)]dec-1-ylphenoxy)acetic acid;[4-(Adamantyl-1)phenoxy]acetic acid;2-[4-(1-adamantyl)phenoxy]acetic acid;2-[4-(1-adamantyl)phenoxy]ethanoic acid;BAS 00285042;CBDivE_002637
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CAS No:
2-(4-(adaMantan-1-yl)phenoxy)acetic acid Use and Manufacturing
To a solution of (4-adamantyl-1-yl-phenoxy)acetic acid ethyl ester 6 (1.10 g, 3.50 mmol) in THF/HGeneral procedure: A mixture of 4 (1.53 g, 5.0 mmol), lithium hydroxide monohydrate (258 mg, 6.1 mmol) in a 1:1 solution of THF and water (12 mL) was stirred at room temperature for 5 min. The reaction was quenched by HCl solution (1 N) and the organic solvent was removed under reduced pressure. The crude products were extracted with ethyl acetate, washed with saturated aqueous NaCl solution, dried over anhydrous MgSO
Computed Properties
Molecular Weight:286.4
XLogP3:4.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:286.15689456
Monoisotopic Mass:286.15689456
Topological Polar Surface Area:46.5
Heavy Atom Count:21
Complexity:367
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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2-(4-(adaMantan-1-yl)phenoxy)acetic acid
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