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Structure

3,3'-Dioctylthiacarbocyanine iodide

CAS
53213-89-1
Catalog Number
ACM53213891
Category
Other Products
Molecular Weight
660.76
Molecular Formula
C33H45IN2S2

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Specification

Synonyms
DiSC8(3), 3,3 inverted exclamation marka-Dioctylthiacarbocyanine iodide, 53213-89-1
IUPAC Name
(2Z)-3-octyl-2-[(E)-3-(3-octyl-1,3-benzothiazol-3-ium-2-yl)prop-2-enylidene]-1,3-benzothiazole;iodide
Canonical SMILES
CCCCCCCCN1C2=CC=CC=C2SC1=CC=CC3=[N+](C4=CC=CC=C4S3)CCCCCCCC.[I-]
InChI Key
MYIUORMVYDSCRZ-UHFFFAOYSA-M
Exact Mass
660.20700
H-Bond Acceptor
4
H-Bond Donor
0
WGK Germany
3
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