Methyl 5-bromobenzo[b]thiophene-2-carboxylate
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Methyl 5-bromobenzo[b]thiophene-2-carboxylate
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CAS No:
7312-11-0
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Formula:
C10H7BrO2S
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Chemical Name:
Methyl 5-bromobenzo[b]thiophene-2-carboxylate
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Synonyms:
Benzo[b]thiophene-2-carboxylic acid,5-bromo-,methyl ester;5-Bromobenzothiophene-2-carboxylic acid methyl ester;Methyl 5-bromobenzo[b]thiophen-2-carboxylate;Methyl 5-bromobenzo[b]thiophene-2-carboxylate;5-Bromobenzo[b]thiophene-2-carboxylic acid methyl ester
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CAS No:
Methyl 5-bromobenzo[b]thiophene-2-carboxylate Basic Attributes
271.130
271.13
DTXSID00384973
2934999090
Safety Information
P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, P501
H302+H312+H332
|Warning|H302+H312+H332 (100%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Methyl 5-bromobenzo[b]thiophene-2-carboxylate Use and Manufacturing
5-Bromobenzothiophene-2-carboxylic acid methyl ester is used in the preparation of new derivatives of (heterocycle-tetrahydropyridine)-(piperazinyl)-1-alkanone and (heterocycle-dihydropyrrolidine)-(piperazinyl)-1-alkanone, as p75 neurotrophin receptor ligands for treating neurological and neurodegenerative diseases.
Computed Properties
Molecular Weight:271.13
XLogP3:3.8
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:269.93501
Monoisotopic Mass:269.93501
Topological Polar Surface Area:54.5
Heavy Atom Count:14
Complexity:234
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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Methyl 5-bromobenzo[b]thiophene-2-carboxylate
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