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  2. 8-(methoxymethyl)-1-methyl-3-(2-methylpropyl)-7H-purine-2,6-dione

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Brc1cnc(nc1)C
Pyrimidine, 5-bromo-2-methyl-
CCCP1(=O)OP(=O)(CCC)OP(=O)(O1)CCC
1,3,5,2,4,6-Trioxatriphosphorinane, 2,4,6-tripropyl-, 2,4,6-trioxide
CC1(C)OB(OC1(C)C)B1OC(C(O1)(C)C)(C)C
2,2'-Bi-1,3,2-dioxaborolane, 4,4,4',4',5,5,5',5'-octamethyl-
O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.[Pd].[Pd]
Tris(dibenzylideneacetone)dipalladium
C1CCC(CC1)P(C1CCCCC1)C1CCCCC1.Cc1cc(C)c(c(c1)C)N1CCN(C1=[Ru](=Cc1ccccc1)(Cl)Cl)c1c(C)cc(cc1C)C
Ruthenium,[1,3-bis(2,4,6-trimethylphenyl)-2-imidazolidinylidene]dichloro(phenylmethylene)(tricyclohexylphosphine)-, (SP-5-41)-

8-(methoxymethyl)-1-methyl-3-(2-methylpropyl)-7H-purine-2,6-dione

COCc1[nH]c2c(n1)n(CC(C)C)c(=O)n(c2=O)C Request for Quotation
Chemical Name: 8-(methoxymethyl)-1-methyl-3-(2-methylpropyl)-7H-purine-2,6-dione
CAS Number: 78033-08-6
Product Number: AG003JLY(AGN-PC-0JPKON)
Synonyms:
MDL No:
Molecular Formula: C12H18N4O3
Molecular Weight: 266.2963

Identification/Properties

Properties
MP:
194-200°C
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
266.301g/mol
XLogP3:
1.6
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
4
Exact Mass:
266.138g/mol
Monoisotopic Mass:
266.138g/mol
Topological Polar Surface Area:
78.5A^2
Heavy Atom Count:
19
Formal Charge:
0
Complexity:
374
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information

GHS Pictogram:
N/A
Signal Word:
UN#:
N/A
Hazard Statements:
-
Precautionary Statements:
Class:
N/A
Packing Group:
N/A

NMR Spectrum

Other Analytical Data

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Chemical Structure


8-Methoxymethyl-isobutyryl-1-methylxanthine is a powerful chemical reagent with versatile applications in chemical synthesis. Its unique molecular structure makes it a valuable tool for organic chemists seeking to introduce methoxy and methyl functional groups into complex molecules. In synthesis, this compound acts as an efficient acylating agent, facilitating the selective introduction of various substituents in organic substrates. By leveraging the reactivity of its xanthine core, chemists can access a wide range of derivatives with tailored properties for use in pharmaceuticals, agrochemicals, and materials science. Furthermore, the mild reaction conditions required for its utilization make it an attractive option for achieving selective transformations in sensitive substrates.