CAS
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Specification
The molecular formula is C8H8N2O2.
The molecular weight is 164.16 g/mol.
The IUPAC name is 7-amino-4H-1,4-benzoxazin-3-one.
The InChI is InChI=1S/C8H8N2O2/c9-5-1-2-6-7(3-5)12-4-8(11)10-6/h1-3H,4,9H2,(H,10,11).
The InChIKey is RUZXDTHZHJTTRO-UHFFFAOYSA-N.
The canonical SMILES is C1C(=O)NC2=C(O1)C=C(C=C2)N.
The CAS number is 26215-14-5.
It has 2 hydrogen bond donor counts.
It has 3 hydrogen bond acceptor counts.