1,3-Dipropyl-7-methylxanthine
CAS Registry Number®
31542-63-9
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CAS Name
1,3-Dipropyl-7-methylxanthineMolecular Formula
C12H18N4O2Molecular Mass
250.30Cite this Page
1,3-Dipropyl-7-methylxanthine. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=31542-63-9 (retrieved ) (CAS RN: 31542-63-9). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
114-116 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C12H18N4O2/c1-4-6-15-10-9(14(3)8-13-10)11(17)16(7-5-2)12(15)18/h8H,4-7H2,1-3H3
InChIKey
InChIKey=QVAYTZAGDQIWMB-UHFFFAOYSA-N
SMILES
C(CC)N1C2=C(C(=O)N(CCC)C1=O)N(C)C=N2
Canonical SMILES
O=C1C2=C(N=CN2C)N(C(=O)N1CCC)CCC
Other Names for this Substance
- 1H-Purine-2,6-dione, 3,7-dihydro-7-methyl-1,3-dipropyl-
- Heteroxanthine, 1,3-dipropyl-
- 3,7-Dihydro-7-methyl-1,3-dipropyl-1H-purine-2,6-dione
- 7-Methyl-1,3-dipropylxanthine
- 1,3-Dipropylheteroxanthine
