6H-Pyrrolo[3,4-d]pyrimidine-6-carboxylic acid, 3,4,5,7-tetrahydro-4-oxo-, 1,1-dimethylethyl ester

Chemical Properties

Boiling point	374.7±52.0 °C(Predicted)
Density	1.34±0.1 g/cm3(Predicted)
storage temp.	2-8°C
form	solid
pka	1.52±0.20(Predicted)
Appearance	yellow solid
InChI	1S/C11H15N3O3/c1-11(2,3)17-10(16)14-4-7-8(5-14)12-6-13-9(7)15/h6H,4-5H2,1-3H3,(H,12,13,15)
InChIKey	BXXXVYDHJCLIKQ-UHFFFAOYSA-N
SMILES	CC(C)(OC(N1CC(N=CNC2=O)=C2C1)=O)C

Storage Class	11 - Combustible Solids
Hazard Classifications	Acute Tox. 4 Oral

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