7,8,10-Trimethylbenzo[g]Pteridine-2,4-Dione
[CAS# 1088-56-8]

Identification

• Name: 7,8,10-Trimethylbenzo[g]Pteridine-2,4-Dione
• Synonyms: 7,8,10-Trimethylbenzo[G]Pteridine-2,4-Quinone; Zinc00391159; Chebi:43661
• Molecular Formula: C₁₃H₁₂N₄O₂
• Molecular Weight: 256.26
• CAS Registry Number: 1088-56-8
• EINECS: 214-125-5
• SMILES: C1=C(C(=CC3=C1N=C2C(=O)NC(N=C2N3C)=O)C)C
• InChI: 1S/C13H12N4O2/c1-6-4-8-9(5-7(6)2)17(3)11-10(14-8)12(18)16-13(19)15-11/h4-5H,1-3H3,(H,16,18,19)
• InChIKey: KPDQZGKJTJRBGU-UHFFFAOYSA-N

Properties

• Density: 1.5±0.1g/cm³ (Cal.)

Safety Data

• Safety Description: Safety glasses. Do not breathe dust.

References

• (1): Ram Kinkar Roy and Soumen Saha. Studies of regioselectivity of large molecular systems using DFT based reactivity descriptors, Annu. Rep. Prog. Chem., Sect. C: Phys. Chem., 2010, 106, 118.