N-[(4-Methylphenyl)sulfonyl]-β-alanine
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![N-[(4-Methylphenyl)sulfonyl]-β-alanine structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/94a433563bac4bd18d7ab8aedab4b9f1.png "N-[(4-Methylphenyl)sulfonyl]-β-alanine")
N-[(4-Methylphenyl)sulfonyl]-β-alanine
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CAS No:
42908-33-8
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Formula:
C10H13NO4S
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Chemical Name:
N-[(4-Methylphenyl)sulfonyl]-β-alanine
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Synonyms:
β-Alanine,N-[(4-methylphenyl)sulfonyl]-;β-Alanine,N-(p-tolylsulfonyl)-;N-[(4-Methylphenyl)sulfonyl]-β-alanine;N-Tosyl-β-alanine;N-p-Tolylsulfonyl-β-alanine;NSC 105599;3-(4-Methylphenylsulfonamido)propanoic acid;3-[(4-Methylphenyl)sulfonylamino]propanoic acid;3-[[(4-Methylphenyl)sulfonyl]amino]propanoic acid
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CAS No:
N-[(4-Methylphenyl)sulfonyl]-β-alanine Basic Attributes
243.28000
243.28
105599
DTXSID70295805
2922499990
Computed Properties
Molecular Weight:243.28
XLogP3:0.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:243.05652907
Monoisotopic Mass:243.05652907
Topological Polar Surface Area:91.8
Heavy Atom Count:16
Complexity:325
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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