2-Amino-5-bromobenzoic acid ethyl ester
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2-Amino-5-bromobenzoic acid ethyl ester
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CAS No:
63243-76-5
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Formula:
C9H10BrNO2
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Chemical Name:
2-Amino-5-bromobenzoic acid ethyl ester
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Synonyms:
Benzoic acid,2-amino-5-bromo-,ethyl ester;5-Bromoanthranilic acid ethyl ester;Ethyl 5-bromoanthranilate;2-Amino-5-bromobenzoic acid ethyl ester
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CAS No:
2-Amino-5-bromobenzoic acid ethyl ester Basic Attributes
244.09
244.09
613-196-3
DTXSID50363935
2922499990
Characteristics
52.3
3.7
1.5±0.1 g/cm3
187 °C @ Solvent: Ethanol
301.2ºC at 760 mmHg
136.0±22.3 °C
1.588
2-Amino-5-bromobenzoic acid ethyl ester Use and Manufacturing
Into a 100-mL 3 -necked round-bottom flask, were placed compound 1.1 (5 g, 23.14 mmol, 1.00 equiv) and ethanol (100 mL). Hydrogen chloride gas was introduced and resulting solution was refluxed overnight. The reaction was then quenched by the addition of saturated sodium bicarbonate and solvents were removed under vacuum. Crude was purified using flash column chromatography to provide 2.5 g (44percent) of compound 1.2 as a yellow solid.
Computed Properties
Molecular Weight:244.08
XLogP3:3.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:242.98949
Monoisotopic Mass:242.98949
Topological Polar Surface Area:52.3
Heavy Atom Count:13
Complexity:187
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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2-Amino-5-bromobenzoic acid ethyl ester
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