2,1-Benzisothiazole-3-carboxylic acid
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2,1-Benzisothiazole-3-carboxylic acid
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CAS No:
34250-66-3
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Formula:
C8H5NO2S
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Chemical Name:
2,1-Benzisothiazole-3-carboxylic acid
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Synonyms:
2,1-Benzisothiazole-3-carboxylic acid;2,1-benzothiazole-3-carboxylic acid;2,1-Benzisothiazole-3-carboxylicacid;Benzo[c]isothiazole-3-carboxylic acid;SCHEMBL3984394;CTK1C0955;DTXSID60482207;2,1-benzothiazole-3-carboxylicacid;ZINC39190106;AKOS006327880
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CAS No:
Safety Information
|Warning|H302 (100%): 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 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:179.20
XLogP3:2.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:179.00409958
Monoisotopic Mass:179.00409958
Topological Polar Surface Area:78.4
Heavy Atom Count:12
Complexity:198
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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2,1-Benzisothiazole-3-carboxylic acid
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