6-Benzothiazoleacetic acid
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6-Benzothiazoleacetic acid
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CAS No:
98589-45-8
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Formula:
C9H7NO2S
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Chemical Name:
6-Benzothiazoleacetic acid
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Synonyms:
6-Benzothiazoleacetic acid;Benzothiazol-6-ylacetic acid;2-(1,3-Benzothiazol-6-yl)acetic acid
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CAS No:
Safety Information
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:193.22
XLogP3:1.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:193.01974964
Monoisotopic Mass:193.01974964
Topological Polar Surface Area:78.4
Heavy Atom Count:13
Complexity:210
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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