Oxonol 595

Base Information

• Chemical Name: Oxonol 595
• CAS No.: 88969-31-7
• Molecular Formula: C27H35N5O4
• Molecular Weight: 493.5979
• European Community (EC) Number: 289-457-7
• Mol file: 88969-31-7.mol

Synonyms:Oxonol 595;88969-31-7;SCHEMBL3370379;SCHEMBL6679130;HY-D1512;CS-0534849;5-(3-(5-Cyano-1-ethyl-4-methyl-2,6-dioxo-1,6-dihydropyridin-3(2H)-ylidene)prop-1-en-1-yl)-1-ethyl-6-hydroxy-4-methyl-2-oxo-1,2-dihydropyridine-3-carbonitrile triethylamine salt

Chemical Property of Oxonol 595

Chemical Property:

• Vapor Pressure: 9.76E-10mmHg at 25°C
• Boiling Point: 443.7°C at 760 mmHg
• Flash Point: 222.1°C
• PSA: 130.43000
• LogP: 3.20826
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 7
• Exact Mass: 493.26890461
• Heavy Atom Count: 36
• Complexity: 1090

Purity/Quality:

98%+ ^*data from raw suppliers

Oxonol595 ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xn
• Statements: 20/21/22-36/37/38
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CCN1C(=C(C(=C(C1=O)C#N)C)C=CC=C2C(=C(C(=O)N(C2=O)CC)C#N)C)O.CCN(CC)CC
• Isomeric SMILES: CCN1C(=C(C(=C(C1=O)C#N)C)/C=C/C=C/2\C(=C(C(=O)N(C2=O)CC)C#N)C)O.CCN(CC)CC
• Uses: Oxonol 595 is a pyridine fluorescent probe. Useful for the examination of charge in organic semiconductors.