CAS 14696-39-0 1,1'-Diethyl-3,3,3',3'-tetramethylindocarbocyanine Iodide, ≥98%

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1,1'-Diethyl-3,3,3',3'-tetramethylindocarbocyanine Iodide, ≥98%

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Catalog Number

ACM14696390-2

Product Name

1,1'-Diethyl-3,3,3',3'-tetramethylindocarbocyanine Iodide, ≥98%

Structure

CAS

14696-39-0

Category

Other Materials

IUPAC Name

1-ethyl-2-[3-(1-ethyl-3,3-dimethylindol-1-ium-2-yl)prop-2-enylidene]-3,3-dimethylindole;iodide

Molecular Weight

512.5g/mol

Molecular Formula

C27H33IN2

Canonical SMILES

CCN1C2=CC=CC=C2C(C1=CC=CC3=[N+](C4=CC=CC=C4C3(C)C)CC)(C)C.[I-]

InChI

InChI=1S/C27H33N2.HI/c1-7-28-22-16-11-9-14-20(22)26(3,4)24(28)18-13-19-25-27(5,6)21-15-10-12-17-23(21)29(25)8-2;/h9-19H,7-8H2,1-6H3;1H/q+1;/p-1

InChI Key

LGRNGKUSEZTBMB-UHFFFAOYSA-M

Complexity

650

Covalently-Bonded Unit Count

Exact Mass

512.16885g/mol

Formal Charge

Heavy Atom Count

Monoisotopic Mass

512.16885g/mol

Rotatable Bond Count

MSDS

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COA

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Spec Sheet

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