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Sulfo-Cy5 alkyne
| Catalog Number | CCR1617497194 |
| CAS | 1617497-19-4 |
| IUPAC Name | Sodium;(2Z)-3,3-dimethyl-1-[6-oxo-6-(prop-2-ynylamino)hexyl]-2-[(2E,4E)-5-(1,3,3-trimethyl-5-sulfonatoindol-1-ium-2-yl)penta-2,4-dienylidene]indole-5-sulfonate |
| Molecular Weight | 701.8 |
| Molecular Formula | C35H40N3NaO7S2 |
| Canonical SMILES | CC1(C2=C(C=CC(=C2)S(=O)(=O)[O-])[N+](=C1C=CC=CC=C3C(C4=C(N3CCCCCC(=O)NCC#C)C=CC(=C4)S(=O)(=O)[O-])(C)C)C)C.[Na+] |
| InChI | InChI=1S/C35H41N3O7S2.Na/c1-7-21-36-33(39)16-12-9-13-22-38-30-20-18-26(47(43,44)45)24-28(30)35(4,5)32(38)15-11-8-10-14-31-34(2,3)27-23-25(46(40,41)42)17-19-29(27)37(31)6;/h1,8,10-11,14-15,17-20,23-24H,9,12-13,16,21-22H2,2-6H3,(H2-,36,39,40,41,42,43,44,45);/q;+1/p-1 |
| InChI Key | FBFMHITXFHJTID-UHFFFAOYSA-M |
| Purity | 96% |
| Solubility | Soluble in water, DMSO, DMF, DCM |
| Application | CuAAC & Thiol-Yne & Spontaneous Amino-Yne Click Reaction |
| Storage | -20 °C |
| Complexity | 1540 |
| Exact Mass | 701.22053725 |
| Isomeric SMILES | CC1(C2=C(C=CC(=C2)S(=O)(=O)[O-])[N+](=C1/C=C/C=C/C=C\3/C(C4=C(N3CCCCCC(=O)NCC#C)C=CC(=C4)S(=O)(=O)[O-])(C)C)C)C.[Na+] |
| Monoisotopic Mass | 701.22053725 |
| Topological Polar Surface Area | 167Ų |
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