CAS 514-73-8 3,3-Diethylthiadicarbocyanine iodide

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3,3-Diethylthiadicarbocyanine iodide

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Catalog Number

ACM514738

Product Name

3,3-Diethylthiadicarbocyanine iodide

Structure

CAS

514-73-8

Category

Other Materials

Synonyms

DELVEX;DEJO;COMPOUND 01748;EASTMAN 7663;DILOMBRIN;DILOMBRINE;DIETHYLTHIADICARBOCYANINE IODIDE;DITHIAZANINE IODIDE

Description

Dithiazanine iodide appears as green, needle-like crystals. Used as a veterinary anthelmintic, as a sensitizer for photographic emulsions and as an insecticides. Not registered as a pesticide in the U.S. (EPA, 1998)

IUPAC Name

(2E)-3-ethyl-2-[(2E,4E)-5-(3-ethyl-1,3-benzothiazol-3-ium-2-yl)penta-2,4-dienylidene]-1,3-benzothiazole;iodide

Molecular Weight

518.5g/mol

Molecular Formula

C23H23IN2S2

Canonical SMILES

CCN1C2=CC=CC=C2SC1=CC=CC=CC3=[N+](C4=CC=CC=C4S3)CC.[I-]

InChI

InChI=1S/C23H23N2S2.HI/c1-3-24-18-12-8-10-14-20(18)26-22(24)16-6-5-7-17-23-25(4-2)19-13-9-11-15-21(19)27-23;/h5-17H,3-4H2,1-2H3;1H/q+1;/p-1

InChI Key

MNQDKWZEUULFPX-UHFFFAOYSA-M

Melting Point

Decomposes at 478.4° F (EPA, 1998)

Solubility

Practically insoluble in water;Practically insoluble in ether;Very slightly soluble in alcohol and methyl alcohol;Can be solubilized with polyvinylpyrrolidone: Canadian Patent: 676,636 (1963 to GAF).

Color/Form

Dark greenish crystalline powder;Blue violet powder

Complexity

537

Covalently-Bonded Unit Count

EC Number

208-186-7

Exact Mass

518.03474g/mol

Formal Charge

Heavy Atom Count

MeSH Entry Terms