ETHYL 6-HYDROXY-2-NAPHTHOATE
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ETHYL 6-HYDROXY-2-NAPHTHOATE
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CAS No:
17295-12-4
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Formula:
C13H12O3
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Chemical Name:
ETHYL 6-HYDROXY-2-NAPHTHOATE
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Synonyms:
Ethyl 6-hydroxy-2-naphthoate;Ethyl 6-hydroxynaphthalene-2-carboxylate;ethyl 6-hydroxyl-2-naphthate;2-Naphthalenecarboxylic acid, 6-hydroxy-, ethyl ester;SCHEMBL2128648;Ethyl 6-naphthol-2-carboxylate;DTXSID40377809;KS-00003TK4;8922AA;ANW-71904
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CAS No:
Characteristics
46.5
3
1.225±0.06 g/cm3(Predicted)
139-140.5 °C(Solv: ethanol (64-17-5))
378.7±15.0 °C(Predicted)
164.7ºC
1.625
ETHYL 6-HYDROXY-2-NAPHTHOATE Use and Manufacturing
Compound 161a:; 161aTo an ethanol solution (50 mL ) of 6-hydroxy-naphthalene-2-carboxylic acid (5.29 g, 28.0 mmol) was added thionyl chloride (6 mL ) at 0°C. The mixture was stirred at room temperature for 72h. Excess reagents were evaporated. The residue was dissolved in ethyl acetate (100 mL ). The ethyl acetate solution was washed with water (80 ml_), cold 1 M sodium bicarbonate (80 ml.) and brine (80 mL ). It was dried over NaTo the solution of 6-hydroxy-2-naphthaoic acid (10.0 g, 0.053 mol) dissolved in 100 mL of EtOH was added 2.0 mL of H
Computed Properties
Molecular Weight:216.23
XLogP3:3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:216.078644241
Monoisotopic Mass:216.078644241
Topological Polar Surface Area:46.5
Heavy Atom Count:16
Complexity:252
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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