Pentanedioic acid, compd. with 3,7-dihydro-1,3,7-trimethyl-1H-purine-2,6-dione (1:1)

CAS Registry Number®

848725-90-6

CAS Name

Pentanedioic acid, compd. with 3,7-dihydro-1,3,7-trimethyl-1H-purine-2,6-dione (1:1)

Molecular Formula

C8H10N4O2.C5H8O4

Molecular Mass

326.31

Cite this Page

Pentanedioic acid, compd. with 3,7-dihydro-1,3,7-trimethyl-1H-purine-2,6-dione (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=848725-90-6 (retrieved 2025-07-16) (CAS RN: 848725-90-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C8H10N4O2.C5H8O4/c1-10-4-9-6-5(10)7(13)12(3)8(14)11(6)2;6-4(7)2-1-3-5(8)9/h4H,1-3H3;1-3H2,(H,6,7)(H,8,9)

InChIKey

InChIKey=YJDSTPMUKKXYPG-UHFFFAOYSA-N

SMILES

C(CC(O)=O)CC(O)=O.O=C1C2=C(N(C)C(=O)N1C)N=CN2C

Canonical SMILES

O=C(O)CCCC(=O)O.O=C1C2=C(N=CN2C)N(C(=O)N1C)C

Other Names for this Substance

  • Pentanedioic acid, compd. with 3,7-dihydro-1,3,7-trimethyl-1H-purine-2,6-dione (1:1)
  • Caffeine, compd. with Glutaric acid (1:1)

CAS INSIGHTSTM
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