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Methyltetrazine-sulfo-NHS ester
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Methyltetrazine-sulfo-NHS ester

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Catalog NumberCCR1821017462
CAS1821017-46-2
SynonymsMethyltetrazine-sulfo-NHS ester (sodium)
IUPAC NameSodium;1-[2-[4-(6-methyl-1,2,4,5-tetrazin-3-yl)phenyl]acetyl]oxy-2,5-dioxopyrrolidine-3-sulfonate
Molecular Weight429.3
Molecular FormulaC15H12N5NaO7S
Canonical SMILESCC1=NN=C(N=N1)C2=CC=C(C=C2)CC(=O)ON3C(=O)CC(C3=O)S(=O)(=O)[O-].[Na+]
InChIInChI=1S/C15H13N5O7S.Na/c1-8-16-18-14(19-17-8)10-4-2-9(3-5-10)6-13(22)27-20-12(21)7-11(15(20)23)28(24,25)26;/h2-5,11H,6-7H2,1H3,(H,24,25,26);/q;+1/p-1
InChI KeyDSVIJQIFAWOGME-UHFFFAOYSA-M
ApplicationIEDDA Click Reaction
Complexity730
Exact Mass429.03551319
Monoisotopic Mass429.03551319
Topological Polar Surface Area181Ų

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