2-[3-(carboxymethyl)-2-oxo-4H-1,4-benzothiazin-3-yl]acetic acid
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![2-[3-(carboxymethyl)-2-oxo-4H-1,4-benzothiazin-3-yl]acetic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/6338bdda44d34f658dc091dff9bcea6b.png "2-[3-(carboxymethyl)-2-oxo-4H-1,4-benzothiazin-3-yl]acetic acid")
2-[3-(carboxymethyl)-2-oxo-4H-1,4-benzothiazin-3-yl]acetic acid
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CAS No:
6289-18-5
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Formula:
C12H11NO5S
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Chemical Name:
2-[3-(carboxymethyl)-2-oxo-4H-1,4-benzothiazin-3-yl]acetic acid
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Synonyms:
NSC5620;MLS002637821;6289-18-5;NSC-5620;NCIStruc1_000074;NCIStruc2_000308;CHEMBL1573554;DTXSID80277995;NCI5620;HMS3078O09;ZINC1687058;CCG-37734;NCGC00013060;NCGC00013060-02;NCGC00096184-01;NCI60_004370;SMR001547333;2-[8-(carboxymethyl)-9-oxo-10-thia-7-azabicyclo[4.4.0]deca-1,3,5-trien-8-yl]acetic acid
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CAS No:
2-[3-(carboxymethyl)-2-oxo-4H-1,4-benzothiazin-3-yl]acetic acid Basic Attributes
281.29 g/mol
281.03579362 g/mol
5620
DTXSID80277995
Computed Properties
Molecular Weight:281.29
XLogP3:0.9
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:4
Exact Mass:281.03579362
Monoisotopic Mass:281.03579362
Topological Polar Surface Area:129
Heavy Atom Count:19
Complexity:395
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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