α-Amino-β-methyl-β-sulfino-1H-1,2,3-triazole-1-butanoic acid
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α-Amino-β-methyl-β-sulfino-1H-1,2,3-triazole-1-butanoic acid
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CAS No:
118175-11-4
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Formula:
C7H12N4O4S
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Chemical Name:
α-Amino-β-methyl-β-sulfino-1H-1,2,3-triazole-1-butanoic acid
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Synonyms:
1H-1,2,3-Triazole-1-butanoic acid,α-amino-β-methyl-β-sulfino-;α-Amino-β-methyl-β-sulfino-1H-1,2,3-triazole-1-butanoic acid;2-Amino-3-methyl-3-sulfino-4-(1H-1,2,3-triazol-1-yl)butanoic acid
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CAS No:
Computed Properties
Molecular Weight:248.26
XLogP3:-4.6
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:5
Exact Mass:248.05792605
Monoisotopic Mass:248.05792605
Topological Polar Surface Area:151
Heavy Atom Count:16
Complexity:302
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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α-Amino-β-methyl-β-sulfino-1H-1,2,3-triazole-1-butanoic acid
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