3-[benzenesulfonyl(2-carboxyethyl)amino]propanoic acid
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![3-[benzenesulfonyl(2-carboxyethyl)amino]propanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/f03e49c38085446b937c7aabcddfcfb6.png "3-[benzenesulfonyl(2-carboxyethyl)amino]propanoic acid")
3-[benzenesulfonyl(2-carboxyethyl)amino]propanoic acid
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CAS No:
5401-13-8
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Formula:
C12H15NO6S
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Chemical Name:
3-[benzenesulfonyl(2-carboxyethyl)amino]propanoic acid
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Synonyms:
NSC4755;MLS000084914;3-[benzenesulfonyl(2-carboxyethyl)amino]propanoic acid;CHEMBL1876170;HMS2352J23;NSC-4755;ZINC1680385;5401-13-8;SMR000019260;SR-01000079454;N-(2-carboxyethyl)-N-(phenylsulfonyl)-beta-alanine;SR-01000079454-1
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CAS No:
3-[benzenesulfonyl(2-carboxyethyl)amino]propanoic acid Basic Attributes
301.32 g/mol
301.06200837 g/mol
4755
Computed Properties
Molecular Weight:301.32
XLogP3:0.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:8
Exact Mass:301.06200837
Monoisotopic Mass:301.06200837
Topological Polar Surface Area:120
Heavy Atom Count:20
Complexity:417
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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