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Home > Encyclopedia > 1,3-diethyl-9-methylpurine-2,6-dione

1,3-diethyl-9-methylpurine-2,6-dione

1,3-diethyl-9-methylpurine-2,6-dione structure

1,3-diethyl-9-methylpurine-2,6-dione 

structure
  • CAS No:

    54965-57-0

  • Formula:

    C10H14N4O2

  • Chemical Name:

    1,3-diethyl-9-methylpurine-2,6-dione

  • Synonyms:

    54965-57-0;1,3-Diethyl-7-methyl-1H-purine-2,6(3H,7H)-dione;1,3-Di-ethyl-9-methylxanthine;1,3-Diethyl-9-methyl-1H-purine-2,6(3H,9H)-dione;1H-Purine-2,6-dione, 1,3-diethyl-3,9-dihydro-9-methyl-;ZINC399848;1,3-diethyl-9-methyl-2,3,6,9-tetrahydro-1H-purine-2,6-dione;AKOS024338350;MCULE-7992954006;1,3-Diethyl-9-methyl-3,9-dihydro-1H-purine-2,6-dione;1,3-Diethyl-9-methyl-3,9-dihydro-1H-purine-2,6-dione #

1,3-diethyl-9-methylpurine-2,6-dione Basic Attributes

222.24 g/mol

222.11167570 g/mol

Characteristics

58.4 Ų

Safety Information

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P301+P312, P330, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:222.24
XLogP3:0.3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:222.11167570
Monoisotopic Mass:222.11167570
Topological Polar Surface Area:58.4
Heavy Atom Count:16
Complexity:320
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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