3-Pyridinecarboxylic acid, ((2,3,6,7-tetrahydro-1,3,7-trimethyl-2,6-dioxo-1H-purin-8-yl)imino)di-2,1-ethanediyl ester

Base Information

• Chemical Name: 3-Pyridinecarboxylic acid, ((2,3,6,7-tetrahydro-1,3,7-trimethyl-2,6-dioxo-1H-purin-8-yl)imino)di-2,1-ethanediyl ester
• CAS No.: 135129-42-9
• Molecular Formula: C24H25N7O6
• Molecular Weight: 507.4986
• DSSTox Substance ID: DTXSID60159260
• Wikidata: Q83027576
• Mol file: 135129-42-9.mol

Synonyms:135129-42-9;3-Pyridinecarboxylic acid, ((2,3,6,7-tetrahydro-1,3,7-trimethyl-2,6-dioxo-1H-purin-8-yl)imino)di-2,1-ethanediyl ester;DTXSID60159260;C24H25N7O6;C24-H25-N7-O6;LS-131050

Chemical Property of 3-Pyridinecarboxylic acid, ((2,3,6,7-tetrahydro-1,3,7-trimethyl-2,6-dioxo-1H-purin-8-yl)imino)di-2,1-ethanediyl ester

Chemical Property:

• Vapor Pressure: 3.83E-20mmHg at 25°C
• Boiling Point: 712.4°Cat760mmHg
• Flash Point: 384.6°C
• Density: 1.4g/cm³
• XLogP3: 1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 10
• Rotatable Bond Count: 11
• Exact Mass: 507.18663154
• Heavy Atom Count: 37
• Complexity: 823

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1C2=C(N=C1N(CCOC(=O)C3=CN=CC=C3)CCOC(=O)C4=CN=CC=C4)N(C(=O)N(C2=O)C)C