1 1-Diethyl-4 4-dicarbocyanine iodide

• CAS: 18300-31-7
• Catalog Number: ACM18300317
• Category: Organic & Printed Electronics
• Molecular Weight: 506.4g/mol
• Molecular Formula: C27H27IN2
• Synonyms: 1,1-Diethyl-4,4-dicarbocyanine iodide Dye content 90 %
• IUPAC Name: (4E)-1-ethyl-4-[(2E,4E)-5-(1-ethylquinolin-1-ium-4-yl)penta-2,4-dienylidene]quinoline;iodide
• Canonical SMILES: CCN1C=CC(=CC=CC=CC2=CC=[N+](C3=CC=CC=C23)CC)C4=CC=CC=C41.[I-]
• InChI: InChI=1S/C27H27N2.HI/c1-3-28-20-18-22(24-14-8-10-16-26(24)28)12-6-5-7-13-23-19-21-29(4-2)27-17-11-9-15-25(23)27;/h5-21H,3-4H2,1-2H3;1H/q+1;/p-1
• InChI Key: XDGZLJIBGBJNTI-UHFFFAOYSA-M
• Complexity: 591
• Covalently-Bonded Unit Count: 2
• Exact Mass: 506.1219g/mol
• Formal Charge: 0
• H-Bond Acceptor: 2
• H-Bond Donor: 0
• Heavy Atom Count: 30
• Monoisotopic Mass: 506.1219g/mol
• Rotatable Bond Count: 5

Custom Q&A

What is the molecular formula of 1,1-Diethyl-4,4-dicarbocyanine iodide?

The molecular formula of 1,1-Diethyl-4,4-dicarbocyanine iodide is C27H27IN2.

What is the molecular weight of 1,1-Diethyl-4,4-dicarbocyanine iodide?

The molecular weight of 1,1-Diethyl-4,4-dicarbocyanine iodide is 506.4 g/mol.

What are the synonyms of 1,1-Diethyl-4,4-dicarbocyanine iodide?

Some synonyms of 1,1-Diethyl-4,4-dicarbocyanine iodide are 18300-31-7, (4E)-1-ethyl-4-[(2E,4E)-5-(1-ethylquinolin-1-ium-4-yl)penta-2,4-dienylidene]quinoline;iodide, and 1,1'-Diethyl-4,4'-dicarbocyanine iodide.

When was 1,1-Diethyl-4,4-dicarbocyanine iodide created?

1,1-Diethyl-4,4-dicarbocyanine iodide was created on October 25, 2006.

What is the IUPAC name of 1,1-Diethyl-4,4-dicarbocyanine iodide?

The IUPAC name of 1,1-Diethyl-4,4-dicarbocyanine iodide is (4E)-1-ethyl-4-[(2E,4E)-5-(1-ethylquinolin-1-ium-4-yl)penta-2,4-dienylidene]quinoline;iodide.

What is the InChI of 1,1-Diethyl-4,4-dicarbocyanine iodide?

The InChI of 1,1-Diethyl-4,4-dicarbocyanine iodide is InChI=1S/C27H27N2.HI/c1-3-28-20-18-22(24-14-8-10-16-26(24)28)12-6-5-7-13-23-19-21-29(4-2)27-17-11-9-15-25(23)27;/h5-21H,3-4H2,1-2H3;1H/q+1;/p-1.

How many hydrogen bond donor counts does 1,1-Diethyl-4,4-dicarbocyanine iodide have?

1,1-Diethyl-4,4-dicarbocyanine iodide has 0 hydrogen bond donor counts.

What is the topological polar surface area of 1,1-Diethyl-4,4-dicarbocyanine iodide?

The topological polar surface area of 1,1-Diethyl-4,4-dicarbocyanine iodide is 7.1Ų.

How many defined bond stereocenter counts does 1,1-Diethyl-4,4-dicarbocyanine iodide have?

1,1-Diethyl-4,4-dicarbocyanine iodide has 3 defined bond stereocenter counts.