5-Bromo-2-benzofurancarboxylic acid
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5-Bromo-2-benzofurancarboxylic acid
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CAS No:
10242-11-2
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Formula:
C9H5BrO3
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Chemical Name:
5-Bromo-2-benzofurancarboxylic acid
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Synonyms:
2-Benzofurancarboxylic acid,5-bromo-;5-Bromo-2-benzofurancarboxylic acid;5-Bromocoumarilic acid;5-Bromobenzofuran-2-carboxylic acid;5-Bromobenzo[b]furan-2-carboxylic acid;5-Bromo-2-benzo[b]furancarboxylic acid;5-Bromo-1-benzofuran-2-carboxylic acid
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CAS No:
Characteristics
50.4
3.1
1.784±0.06 g/cm3(Predicted)
257 °C
370.9±22.0 °C(Predicted)
178.1±22.3 °C
1.680
Refrigerated.
3.71E-06mmHg at 25°C
Safety Information
IRRITANT
22-36/37/38
22-26-36/37/39
Xn
P261, P264, P270, P271, P280, P301+P310, P302+P352, P304+P340, P305+P351+P338, P311, P312, P321, P322, P330, P332+P313, P337+P313, P361, P362, P363, P403+P233, P405, P501
H301
|Danger|H301 (50%): Toxic if swallowed [Danger Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P310, P302+P352, P304+P340, P305+P351+P338, P311, P312, P321, P322, P330, P332+P313, P337+P313, P361, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:241.04
XLogP3:3.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:239.94221
Monoisotopic Mass:239.94221
Topological Polar Surface Area:50.4
Heavy Atom Count:13
Complexity:219
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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5-Bromo-2-benzofurancarboxylic acid
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