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3,3'-DIETHYLTHIATRICARBOCYANINE IODIDE

CAS 3071-70-3C25H25IN2S2MW 544.5

3,3'-DIETHYLTHIATRICARBOCYANINE IODIDE (CAS 3071-70-3) — formula C25H25IN2S2, molecular weight 544.5; category organic chemicals.

Product Overview

CAS Number3071-70-3
Molecular FormulaC25H25IN2S2
Molecular Weight544.5
CategoryOrganic Chemicals

Technical Profile

What this product is

3,3'-DIETHYLTHIATRICARBOCYANINE IODIDE is a carbon-based organic compound with CAS registry number 3071-70-3 and molecular formula C25H25IN2S2 (molecular weight 544.5), belonging to the organic chemicals segment of chemical raw materials.

Identification

CAS number: 3071-70-3

Its molecular formula C25H25IN2S2 comprises 25 C, 25 H, 1 I, 2 N, 2 S atoms.

Also known as: 3,3'-DIETHYLTHIATRICARBOCYANINE IODIDE · 3,3'-二乙基硫代三碳菁碘化物

Category: organic chemicals

Frequently Asked Questions

What is the CAS number of 3,3'-DIETHYLTHIATRICARBOCYANINE IODIDE?

The CAS registry number of 3,3'-DIETHYLTHIATRICARBOCYANINE IODIDE is 3071-70-3.

What is the molecular formula and molecular weight of 3,3'-DIETHYLTHIATRICARBOCYANINE IODIDE?

Molecular formula C25H25IN2S2, molecular weight 544.5.

What other names is 3,3'-DIETHYLTHIATRICARBOCYANINE IODIDE known by?

It is also registered under: 3,3'-DIETHYLTHIATRICARBOCYANINE IODIDE, 3,3'-二乙基硫代三碳菁碘化物.

Which category does 3,3'-DIETHYLTHIATRICARBOCYANINE IODIDE belong to?

Category: Organic Chemicals.

PubChem Public Data

Independent reference data for 3,3'-DIETHYLTHIATRICARBOCYANINE IODIDE (CAS 3071-70-3), compiled from public chemistry databases.

Registry identifiers across databases

CAS 号3071-70-3
PubChem CID18305
分子式C25H25IN2S2
IUPAC 名称3-ethyl-2-[7-(3-ethyl-1,3-benzothiazol-3-ium-2-yl)hepta-2,4,6-trienylidene]-1,3-benzothiazole iodide
UNII(FDA)NS00045616

Computed descriptors

Molecular Weight544.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Exact Mass544.05039
Monoisotopic Mass544.05039
Topological Polar Surface Area60.7
Heavy Atom Count30

Synonyms and trade names

3071-70-3; 3,3'-Diethylthiatricarbocyanineiodide; DiSC2(7); 3-Ethyl-2-[7-[3-ethyl-2(3H)-benzothiazolylidene]-1,3,5-heptatrienyl]benzothiazolium Iodide; 3-ethyl-2-[7-(3-ethyl-1,3-benzothiazol-3-ium-2-yl)hepta-2,4,6-trienylidene]-1,3-benzothiazole;iodide; Benzothiazolium, 3-ethyl-2-(7-(3-ethyl-2(3H)-benzothiazolylidene)-1,3,5-heptatrienyl)-, iodide; Benzothiazolium, 3-ethyl-2-[7-(3-ethyl-2(3H)-benzothiazolylidene)-1,3,5-heptatrienyl]-, iodide; SCHEMBL139369; orb2566374; SCHEMBL7761433; C25H25IN2S2; OYVFJKVYVDYPFV-UHFFFAOYSA-M; NS00045616; F554899; F9995-0021; 3,3'-Diethylthiatricarbocyanine Iodide, inverted exclamation markO98%; 3-Ethyl-2-[7-(3-ethyl-1,3-benzothiazol-2(3H)-ylidene)hepta-1,3,5-trien-1-yl]-1,3-benzothiazol-3-ium iodide

What the public record says

3,3'-二乙基硫代三碳菁碘化物 · CAS 3071-70-3 · C25H25IN2S2. UNII NS00045616.

Source: PubChem / Wikidata; the batch COA governs where values differ.

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