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Sulfo DBCO-TFP ester
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Sulfo DBCO-TFP ester

Catalog NumberCCR2268816766
CAS2268816-76-6
IUPAC Name3-[[4-(2-Azatricyclo[10.4.0.04,9]hexadeca-1(16),4,6,8,12,14-hexaen-10-yn-2-yl)-4-oxobutanoyl]amino]-1-oxo-1-(2,3,5,6-tetrafluorophenoxy)propane-2-sulfonic acid
Molecular Weight604.5
Molecular FormulaC28H20F4N2O7S
Canonical SMILESC1C2=CC=CC=C2C#CC3=CC=CC=C3N1C(=O)CCC(=O)NCC(C(=O)OC4=C(C(=CC(=C4F)F)F)F)S(=O)(=O)O
InChIInChI=1S/C28H20F4N2O7S/c29-19-13-20(30)26(32)27(25(19)31)41-28(37)22(42(38,39)40)14-33-23(35)11-12-24(36)34-15-18-7-2-1-5-16(18)9-10-17-6-3-4-8-21(17)34/h1-8,13,22H,11-12,14-15H2,(H,33,35)(H,38,39,40)
InChI KeyOXCOLSMUBAPWNW-UHFFFAOYSA-N
ApplicationSPAAC & SPANC Click Reaction
Complexity1170
Exact Mass604.09273480
Monoisotopic Mass604.09273480
Topological Polar Surface Area139Ų

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