Formula |
C9H12N4O2 |
IUPAC Name |
3-methyl-1-propyl-7,8-dihydropurine-4,5,8,9-tetraide-2,6-dione |
Molecular Mass |
208.217 g·mol−1 |
Heat of Formation |
-234.1 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.80 ± 1.08 D |
Volume |
241.08 Å 3 |
Surface Area |
228.59 Å 2 |
HOMO Energy |
-9.13 ± 0.55 eV |
LUMO Energy |
-0.89 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 1-methyl-3-propylxanthine
- 1-mpx
- 1h-purine-2,6-dione, 3,7-dihydro-3-methyl-1-propyl-
- 3-methyl-1-propyl-7h-purine-2,6-dione
- 3-methyl-1-propyl-7h-purine-2,6-quinone
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CAS Number(s) |
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InChIKey |
UEGOAAXVUJWIHJ-UHFFFAOYSA-N |
QR Code |
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Links |
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Downloads |
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Elements |
H
C
O
N
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