Benzo[b]thiophene-5-carboxylic acid
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![Benzo[b]thiophene-5-carboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/861d076a75b34c47960ccc6eb94da9b9.png "Benzo[b]thiophene-5-carboxylic acid")
Benzo[b]thiophene-5-carboxylic acid
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CAS No:
2060-64-2
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Formula:
C9H6O2S
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Chemical Name:
Benzo[b]thiophene-5-carboxylic acid
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Synonyms:
Benzo[b]thiophene-5-carboxylic acid;1-Benzothiophene-5-carboxylic acid;Benzothiophene-5-carboxylic acid
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CAS No:
Safety Information
36
26
Xi
|Warning|H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, 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:178.21
XLogP3:2.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:178.00885060
Monoisotopic Mass:178.00885060
Topological Polar Surface Area:65.5
Heavy Atom Count:12
Complexity:193
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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Benzo[b]thiophene-5-carboxylic acid
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