1,3,7-Trimethyl-8-(phenylmethylamino)purine-2,6-dione

Catalog Number

ACM130187585

Product Name

1,3,7-Trimethyl-8-(phenylmethylamino)purine-2,6-dione

CAS

130187-58-5

Category

Heterocyclic Organic Compound

Synonyms

8-N-Benzylaminocaffeine, CBMicro_047021, ChemDiv2_004144, Oprea1_492508, Oprea1_853689, MLS000110244, STOCK2S-36440, BRN 0385265, MolPort-001-496-127, HMS1380M08, CID64137, STK068759, ZINC00114046, IDI1_002859, BAS 01228979, SMR000106174, BIM-0046885.P001, LS-127056, 0-26-00-00531 (Beilstein Handbook Reference), 1H-Purine-2,6-dione, 3,7-dihydro-8-((phenylmethyl)amino)-1,3,7-trimethyl-

IUPAC Name

8-(benzylamino)-1,3,7-trimethylpurine-2,6-dione

Molecular Weight

299.328 g/mol

Molecular Formula

C₁₅H₁₇N₅O₂

Canonical SMILES

CN1C2=C(N=C1NCC3=CC=CC=C3)N(C(=O)N(C2=O)C)C

InChI Key

LBVXMQUYMRVXIJ-UHFFFAOYSA-N

Boiling Point

522.3ºC at 760mmHg

Flash Point

269.7ºC

Density

1.34g/cm³

Exact Mass

299.13800

H-Bond Acceptor

4

H-Bond Donor

1

MSDS

COA

Spec Sheet