Structure

Nir-797-isothiocyanate

CAS
152111-91-6
Catalog Number
ACM152111916
Category
Other Products
Molecular Weight
880.14
Molecular Formula
C45H50N3NaO6S4

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Specification

Synonyms
NIR-797 isothiocyanate, CTK8F1359, 152111-91-6
IUPAC Name
sodium;4-[2-[2-[3-[2-[3,3-dimethyl-1-(4-sulfonatobutyl)indol-1-ium-2-yl]ethenyl]-2-(4-isothiocyanatophenyl)sulfanylcyclohex-2-en-1-ylidene]ethylidene]-3,3-dimethylindol-1-yl]butane-1-sulfonate
InChI Key
URQBXUCJHTXMKS-UHFFFAOYSA-M
Exact Mass
879.24800
H-Bond Acceptor
10
H-Bond Donor
0
Safety Description
22-24/25
WGK Germany
3

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