2-Chloro-5-[(3,5-dimethyl-1-piperidinyl)sulfonyl]benzoic acid
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![2-Chloro-5-[(3,5-dimethyl-1-piperidinyl)sulfonyl]benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/61325904395d4180b3cf273aa6e7fe5c.png "2-Chloro-5-[(3,5-dimethyl-1-piperidinyl)sulfonyl]benzoic acid")
2-Chloro-5-[(3,5-dimethyl-1-piperidinyl)sulfonyl]benzoic acid
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CAS No:
24358-29-0
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Formula:
C14H18ClNO4S
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Chemical Name:
2-Chloro-5-[(3,5-dimethyl-1-piperidinyl)sulfonyl]benzoic acid
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Synonyms:
Benzoic acid,2-chloro-5-[(3,5-dimethyl-1-piperidinyl)sulfonyl]-;Benzoic acid,2-chloro-5-[(3,5-dimethylpiperidino)sulfonyl]-;2-Chloro-5-[(3,5-dimethyl-1-piperidinyl)sulfonyl]benzoic acid;2-Chloro-5-(3,5-dimethylpiperidinosulfonyl)benzoic acid;2-Chloro-5-(3,5-dimethylpiperidinosulphonyl)benzoic acid
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CAS No:
2-Chloro-5-[(3,5-dimethyl-1-piperidinyl)sulfonyl]benzoic acid Basic Attributes
331.81502
331.82
246-198-4
DTXSID1020277
Characteristics
83.1
2.9
1.1780 (rough estimate)
Flammable; decomposes toxic hydrogen chloride, sulfur oxides, nitrogen oxide gas
Computed Properties
Molecular Weight:331.8
XLogP3:2.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:331.0645069
Monoisotopic Mass:331.0645069
Topological Polar Surface Area:83.1
Heavy Atom Count:21
Complexity:480
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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2-Chloro-5-[(3,5-dimethyl-1-piperidinyl)sulfonyl]benzoic acid
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