2-(phenoxathiine-4-carbonylamino)propanoic acid
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2-(phenoxathiine-4-carbonylamino)propanoic acid
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CAS No:
35082-60-1
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Formula:
C16H13NO4S
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Chemical Name:
2-(phenoxathiine-4-carbonylamino)propanoic acid
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Synonyms:
MLS003171111;35082-60-1;NSC351895;CHEMBL1878468;DTXSID30319930;NSC-351895;SMR001875019
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CAS No:
2-(phenoxathiine-4-carbonylamino)propanoic acid Basic Attributes
315.3 g/mol
315.05652907 g/mol
351895
DTXSID30319930
Computed Properties
Molecular Weight:315.3
XLogP3:2.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:315.05652907
Monoisotopic Mass:315.05652907
Topological Polar Surface Area:101
Heavy Atom Count:22
Complexity:444
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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