CAS
98-77-1 Purity
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98-77-1 Purity
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Specification
The molecular formula is C6H10N4O.
It was created on February 8, 2007.
The molecular weight is 154.17 g/mol.
The InChIKey is DCVJHVGJGYSRDE-UHFFFAOYSA-N.
The Canonical SMILES is CN1CCN(C2=NON=C21)C.
It has 5 hydrogen bond acceptors.
The topological polar surface area is 45.4 Ų.
There are 11 heavy atoms.
Yes, the compound is canonicalized.
It has 0 rotatable bond counts.