3-ethyl-2,5-dimethyl-1,3-benzothiazol-3-ium
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3-ethyl-2,5-dimethyl-1,3-benzothiazol-3-ium
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CAS No:
42846-18-4
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Formula:
C11H14NS+
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Chemical Name:
3-ethyl-2,5-dimethyl-1,3-benzothiazol-3-ium
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Synonyms:
3-ethyl-2,5-dimethyl-1,3-benzothiazol-3-ium;42846-18-4;CHEMBL4066162;SCHEMBL12364566;UPUJUTOIGKMZBA-UHFFFAOYSA-;ZINC236055;3-Ethyl-2,5-dimethylbenzothiazolium;MCULE-8736590612;EU-0067085;Benzothiazolium, 3-ethyl-2,5-dimethyl-, p-toluenesulfonate
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CAS No:
Computed Properties
Molecular Weight:192.30
XLogP3:3.6
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:192.08469562
Monoisotopic Mass:192.08469562
Topological Polar Surface Area:32.1
Heavy Atom Count:13
Formal Charge:1
Complexity:183
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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