Disulfo-Cy3 alkyne

Online Inquiry

Catalog Number	CCR2055138888
CAS	2055138-88-8
Synonyms	Sodium 2-(3-(3,3-dimethyl-1-(6-oxo-6-(prop-2-yn-1-ylamino)hexyl)-5-sulfonatoindolin-2-ylidene)prop-1-en-1-yl)-1,3,3-trimethyl-3H-indol-1-ium-5-sulfonate
IUPAC Name	Sodium;(2Z)-3,3-dimethyl-1-[6-oxo-6-(prop-2-ynylamino)hexyl]-2-[(E)-3-(1,3,3-trimethyl-5-sulfonatoindol-1-ium-2-yl)prop-2-enylidene]indole-5-sulfonate
Molecular Weight	677.81
Molecular Formula	C33H40N3NaO7S2
Canonical SMILES	CC1(C2=C(C=CC(=C2)S(=O)(=O)[O-])[N+](=C1C=CC=C3C(C4=C(N3CCCCCC(=O)NCC#C)C=CC(=C4)S(=O)(=O)[O-])(C)C)C)C.[Na+]
InChI	InChI=1S/C33H39N3O7S2.Na/c1-7-19-34-31(37)14-9-8-10-20-36-28-18-16-24(45(41,42)43)22-26(28)33(4,5)30(36)13-11-12-29-32(2,3)25-21-23(44(38,39)40)15-17-27(25)35(29)6;/h1,11-13,15-18,21-22H,8-10,14,19-20H2,2-6H3,(H2-,34,37,38,39,40,41,42,43);/q;+1/p-1
InChI Key	UQEWEEUKXKMBNT-UHFFFAOYSA-M
Solubility	Soluble in water, DMSO, DMF, DCM
Application	CuAAC & Thiol-Yne & Spontaneous Amino-Yne Click Reaction
Complexity	1460
Exact Mass	675.20488719
Isomeric SMILES	CC1(C2=C(C=CC(=C2)S(=O)(=O)[O-])[N+](=C1/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	675.20488719
Topological Polar Surface Area	167 Å²

Please kindly note that our products and services are for research use only.