CAS 4727-50-8 1,1'-Diethyl-4,4'-carbocyanine iodide

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1,1'-Diethyl-4,4'-carbocyanine iodide

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Catalog Number

ACM4727508-2

CAS Number

4727-50-8

Product Name

1,1'-Diethyl-4,4'-carbocyanine iodide

Structure

Category

Other Materials

IUPAC Name

(4E)-1-ethyl-4-[(E)-3-(1-ethylquinolin-1-ium-4-yl)prop-2-enylidene]quinoline;iodide

Molecular Weight

480.4g/mol

Molecular Formula

C25H25IN2

Canonical SMILES

CCN1C=CC(=CC=CC2=CC=[N+](C3=CC=CC=C23)CC)C4=CC=CC=C41.[I-]

InChI

InChI=1S/C25H25N2.HI/c1-3-26-18-16-20(22-12-5-7-14-24(22)26)10-9-11-21-17-19-27(4-2)25-15-8-6-13-23(21)25;/h5-19H,3-4H2,1-2H3;1H/q+1;/p-1

InChI Key

CEJANLKHJMMNQB-UHFFFAOYSA-M

Complexity

527

Covalently-Bonded Unit Count

EC Number

225-224-8

Exact Mass

480.10625g/mol

Formal Charge

Heavy Atom Count

MeSH Entry Terms

1,1'-diethyl-4,4'-carbocyanine;crytocyanine;kryptocyanine;kryptocyanine, ethyl sulfate

Monoisotopic Mass

480.10625g/mol

Rotatable Bond Count

MSDS

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COA

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Spec Sheet

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