3-(carboxymethylsulfanyl)-2-(2,4-dinitroanilino)propanoic acid
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3-(carboxymethylsulfanyl)-2-(2,4-dinitroanilino)propanoic acid
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CAS No:
81251-80-1
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Formula:
C11H11N3O8S
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Chemical Name:
3-(carboxymethylsulfanyl)-2-(2,4-dinitroanilino)propanoic acid
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Synonyms:
81251-80-1;s-(carboxymethyl)-n-(2,4-dinitrophenyl)cysteine;NSC118115;DTXSID10297787;NSC-118115
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CAS No:
3-(carboxymethylsulfanyl)-2-(2,4-dinitroanilino)propanoic acid Basic Attributes
345.29 g/mol
345.02668549 g/mol
118115
DTXSID10297787
Computed Properties
Molecular Weight:345.29
XLogP3:2
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:7
Exact Mass:345.02668549
Monoisotopic Mass:345.02668549
Topological Polar Surface Area:204
Heavy Atom Count:23
Complexity:477
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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