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Home › Product Catalog › 3,3'-DIETHYL-9,11,9',11'-BIS(B,B-DIMETHYLTRIMETHYLENE)-THIAPENTACARBOCYANINE IODIDE

3,3'-DIETHYL-9,11,9',11'-BIS(B,B-DIMETHYLTRIMETHYLENE)-THIAPENTACARBOCYANINE IODIDE

CAS 20517-94-6C28H31IN2S2MW 586.6

3,3'-DIETHYL-9,11,9',11'-BIS(B,B-DIMETHYLTRIMETHYLENE)-THIAPENTACARBOCYANINE IODIDE (CAS 20517-94-6) — formula C28H31IN2S2, molecular weight 586.6; category organic chemicals.

Product Overview

CAS Number20517-94-6
Molecular FormulaC28H31IN2S2
Molecular Weight586.6
CategoryOrganic Chemicals

Technical Profile

What this product is

3,3'-DIETHYL-9,11,9',11'-BIS(B,B-DIMETHYLTRIMETHYLENE)-THIAPENTACARBOCYANINE IODIDE is a carbon-based organic compound with CAS registry number 20517-94-6 and molecular formula C28H31IN2S2 (molecular weight 586.6), belonging to the organic chemicals segment of chemical raw materials.

Identification

CAS number: 20517-94-6

Its molecular formula C28H31IN2S2 comprises 28 C, 31 H, 1 I, 2 N, 2 S atoms.

Also known as: 3,3'-DIETHYL-9,11,9',11'-BIS(B,B-DIMETHYLTRIMETHYLENE)-THIAPENTACARBOCYANINE IODIDE · 3-乙基-2-[[3-[(3-乙基-2(3H)-苯并噻唑亚基)甲基]-5,5-二甲基-2-环己烯-1-亚基]甲基]-苯并噻唑鎓碘化物

Category: organic chemicals

Frequently Asked Questions

What is the CAS number of 3,3'-DIETHYL-9,11,9',11'-BIS(B,B-DIMETHYLTRIMETHYLENE)-THIAPENTACARBOCYANINE IODIDE?

The CAS registry number of 3,3'-DIETHYL-9,11,9',11'-BIS(B,B-DIMETHYLTRIMETHYLENE)-THIAPENTACARBOCYANINE IODIDE is 20517-94-6.

What is the molecular formula and molecular weight of 3,3'-DIETHYL-9,11,9',11'-BIS(B,B-DIMETHYLTRIMETHYLENE)-THIAPENTACARBOCYANINE IODIDE?

Molecular formula C28H31IN2S2, molecular weight 586.6.

What other names is 3,3'-DIETHYL-9,11,9',11'-BIS(B,B-DIMETHYLTRIMETHYLENE)-THIAPENTACARBOCYANINE IODIDE known by?

It is also registered under: 3,3'-DIETHYL-9,11,9',11'-BIS(B,B-DIMETHYLTRIMETHYLENE)-THIAPENTACARBOCYANINE IODIDE, 3-乙基-2-[[3-[(3-乙基-2(3H)-苯并噻唑亚基)甲基]-5,5-二甲基-2-环己烯-1-亚基]甲基]-苯并噻唑鎓碘化物.

Which category does 3,3'-DIETHYL-9,11,9',11'-BIS(B,B-DIMETHYLTRIMETHYLENE)-THIAPENTACARBOCYANINE IODIDE belong to?

Category: Organic Chemicals.

PubChem Public Data

Independent reference data for 3,3'-DIETHYL-9,11,9',11'-BIS(B,B-DIMETHYLTRIMETHYLENE)-THIAPENTACARBOCYANINE IODIDE (CAS 20517-94-6), compiled from public chemistry databases.

Registry identifiers across databases

CAS 号20517-94-6
PubChem CID9916419
分子式C28H31IN2S2
IUPAC 名称(2Z)-3-ethyl-2-[[(3E)-3-[(3-ethyl-1,3-benzothiazol-3-ium-2-yl)methylidene]-5,5-dimethylcyclohexen-1-yl]methylidene]-1,3-benzothiazole iodide

Computed descriptors

Molecular Weight586.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass586.09734
Monoisotopic Mass586.09734
Topological Polar Surface Area60.7
Heavy Atom Count33

Synonyms and trade names

189685-94-7; SCHEMBL30933907; AKOS000814059; EN300-1080607

What the public record says

3-乙基-2-[[3-[(3-乙基-2(3H)-苯并噻唑亚基)甲基]-5,5-二甲基-2-环己烯-1-亚基]甲基]-苯并噻唑鎓碘化物 · CAS 20517-94-6 · C28H31IN2S2.

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

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