1,1',3,3,3',3'-Hexamethylindotricarbocyanine perchlorate

Base Information

• Chemical Name: 1,1',3,3,3',3'-Hexamethylindotricarbocyanine perchlorate
• CAS No.: 16595-48-5
• Molecular Formula: C29H33ClN2O4
• Molecular Weight: 509.04
• Hs Code.: 32049000
• European Community (EC) Number: 240-652-5
• Mol file: 16595-48-5.mol

Synonyms:1,1',3,3,3',3'-hexamethylindotricarbocyanine;HITC

Chemical Property of 1,1',3,3,3',3'-Hexamethylindotricarbocyanine perchlorate

Chemical Property:

• Melting Point: 235 oC
• Refractive Index: 1.6290 (estimate)
• PSA: 80.52000
• Density: 1.0790 (rough estimate)
• LogP: 6.91080
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 508.2128852
• Heavy Atom Count: 36
• Complexity: 852

Purity/Quality:

98%Min ^*data from raw suppliers

1,1',3,3,3',3'-HEXAMETHYLINDOTRI- CARBOCYANINE PERCHLORATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): C-O,Xi,O
• Hazard Codes: C-O,Xi,O
• Statements: 8-34-36/37/38
• Safety Statements: 45-36/37/39-26-17-36

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Chemical Classes: Dyes -> Carbocyanine Dyes
• Canonical SMILES: CC1(C2=CC=CC=C2[N+](=C1C=CC=CC=CC=C3C(C4=CC=CC=C4N3C)(C)C)C)C.[O-]Cl(=O)(=O)=O
• Isomeric SMILES: CC1(C2=CC=CC=C2[N+](=C1/C=C/C=C/C=C/C=C\3/C(C4=CC=CC=C4N3C)(C)C)C)C.[O-]Cl(=O)(=O)=O

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