1-(2-Benzothiazolylmethyl)cyclohexanecarboxylic acid
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1-(2-Benzothiazolylmethyl)cyclohexanecarboxylic acid
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CAS No:
863669-59-4
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Formula:
C15H17NO2S
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Chemical Name:
1-(2-Benzothiazolylmethyl)cyclohexanecarboxylic acid
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Synonyms:
Cyclohexanecarboxylic acid,1-(2-benzothiazolylmethyl)-;1-(2-Benzothiazolylmethyl)cyclohexanecarboxylic acid
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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|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:275.4
XLogP3:4.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:275.09799996
Monoisotopic Mass:275.09799996
Topological Polar Surface Area:78.4
Heavy Atom Count:19
Complexity:341
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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