2-Benzofurancarboxylic acid, 5-nitro-, ethyl ester
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2-Benzofurancarboxylic acid, 5-nitro-, ethyl ester
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CAS No:
69604-00-8
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Formula:
C11H9NO5
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Chemical Name:
2-Benzofurancarboxylic acid, 5-nitro-, ethyl ester
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Synonyms:
2-Benzofurancarboxylic acid,5-nitro-,ethyl ester;Ethyl 5-nitrobenzofuran-2-carboxylate;5-Nitro-2-benzofurancarboxylic acid ethyl ester;Ethyl 5-nitrobenzo[d]furan-2-carboxylate;Ethyl 5-nitrobenzo[b]furan-2-carboxylate;Ethyl 5-nitro-1-benzofuran-2-carboxylate;Ethyl 5-nitrobenzofuran-2-formate
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CAS No:
2-Benzofurancarboxylic acid, 5-nitro-, ethyl ester Basic Attributes
235.19
235.19
614-989-7
BWP4ZD8WZF
2932999099
Characteristics
85.3
2.7
Light yellow to light brown powder
1.4±0.1 g/cm3
152-153 °C
359.7°C at 760 mmHg
171.3±22.3 °C
1.604
2-Benzofurancarboxylic acid, 5-nitro-, ethyl ester Use and Manufacturing
Deriatives of benzofuran-2-carboxylic acid are known for exhibiting various pharmacological activities such as selective adenosine A2A receptor antagonists, anti-inflammatory agents and local anaesthe tics. Benzofuran-2-carboxylic acids bearing benzoyl nitrogen such as Ethyl 5-Nitrobenzofuran-2-carboxylate, are used as DNA-binding groups, where the these structural subunits mimic natural antitumor agents such as duocarmycin and netropsin.
Computed Properties
Molecular Weight:235.19
XLogP3:2.7
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:235.04807239
Monoisotopic Mass:235.04807239
Topological Polar Surface Area:85.3
Heavy Atom Count:17
Complexity:314
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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2-Benzofurancarboxylic acid, 5-nitro-, ethyl ester
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