Cas no 119237-63-7 (Benzo[g]pteridine-2,4(3H,10H)-dione,10-(3,5-dimethylphenyl)-3,7,8-trimethyl-)

Benzo[g]pteridine-2,4(3H,10H)-dione,10-(3,5-dimethylphenyl)-3,7,8-trimethyl- structure
119237-63-7 structure
Product Name:Benzo[g]pteridine-2,4(3H,10H)-dione,10-(3,5-dimethylphenyl)-3,7,8-trimethyl-
CAS No:119237-63-7
MF:C21H20N4O2
MW:360.409104347229
CID:192658
PubChem ID:3082959
Update Time:2025-04-19

Benzo[g]pteridine-2,4(3H,10H)-dione,10-(3,5-dimethylphenyl)-3,7,8-trimethyl- Chemical and Physical Properties

Names and Identifiers

    • Benzo[g]pteridine-2,4(3H,10H)-dione,10-(3,5-dimethylphenyl)-3,7,8-trimethyl-
    • 10-(3,5-dimethylphenyl)-3,7,8-trimethylbenzo[g]pteridine-2,4-dione
    • 10-(3',5'-dimethylphenyl)-3-methylflavin
    • 10-(3,5-dimethylphenyl)-3,7,8-trimethylbenzo[g]pteridine-2,4(3H,10H)-dione
    • 10-Dmpmf
    • Benzo(g)pteridine-2,4(3H,10H)-dione, 10-(3,5-dimethylphenyl)-3,7,8-trimethyl-
    • 119237-63-7
    • DTXSID60152357
    • Inchi: 1S/C21H20N4O2/c1-11-6-12(2)8-15(7-11)25-17-10-14(4)13(3)9-16(17)22-18-19(25)23-21(27)24(5)20(18)26/h6-10H,1-5H3
    • InChI Key: PTMUTTBBHPNBNE-UHFFFAOYSA-N
    • SMILES: O=C1C2C(=NC(N1C)=O)N(C1C=C(C)C=C(C)C=1)C1C=C(C)C(C)=CC=1N=2

Computed Properties

  • Exact Mass: 360.1588
  • Monoisotopic Mass: 360.159
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 27
  • Rotatable Bond Count: 1
  • Complexity: 705
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 3.7
  • Topological Polar Surface Area: 65.3?2

Experimental Properties

  • Density: 1.29
  • Boiling Point: 540.9°Cat760mmHg
  • Flash Point: 280.9°C
  • Refractive Index: 1.671
  • PSA: 65.34

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