CAS
58138-08-2 Purity
99%
58138-08-2 Purity
99%
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The molecular formula is C13H13N3O.
The molecular weight is 227.26 g/mol.
The IUPAC name is 4-amino-N-(2-aminophenyl)benzamide.
The InChI is InChI=1S/C13H13N3O/c14-10-7-5-9(6-8-10)13(17)16-12-4-2-1-3-11(12)15/h1-8H,14-15H2,(H,16,17).
The InChIKey is QGMGHALXLXKCBD-UHFFFAOYSA-N.
The Canonical SMILES is C1=CC=C(C(=C1)N)NC(=O)C2=CC=C(C=C2)N.
The CAS number is 58338-59-3.
The hydrogen bond donor count is 3.
The hydrogen bond acceptor count is not provided.
The XLogP3-AA value is 1.4.