4-CHLORO-5-ISOTHIAZOLECARBOXYLICACID
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4-CHLORO-5-ISOTHIAZOLECARBOXYLICACID
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CAS No:
88982-87-0
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Formula:
C4H2ClNO2S
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Chemical Name:
4-CHLORO-5-ISOTHIAZOLECARBOXYLICACID
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Synonyms:
4-CHLORO-5-ISOTHIAZOLE CARBOXYLIC ACID;4-Chloro-isothiazole-5-carboxylic acid;5-Isothiazolecarboxylic acid, 4-chloro-
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CAS No:
4-CHLORO-5-ISOTHIAZOLECARBOXYLICACID Use and Manufacturing
4-Chloro-5-Isothiazolecarboxylic Acid, is used in the synthesis of Isothiazoles with butyl-lithium, which are useful compounds in organic synthesis. They can react normally to give acids, aldehydes, and alkyl and halegeno- derivatives.
Computed Properties
Molecular Weight:163.58
XLogP3:1.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:162.9494772
Monoisotopic Mass:162.9494772
Topological Polar Surface Area:78.4
Heavy Atom Count:9
Complexity:132
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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