CAS
5192-04-1 Purity
98.0%+
5192-04-1 Purity
98.0%+
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Specification
The molecular formula is C7H6N2.
The molecular weight is 118.14 g/mol.
The IUPAC name is 1H-pyrrolo[3,2-b]pyridine.
The InChI is InChI=1S/C7H6N2/c1-2-6-7(8-4-1)3-5-9-6/h1-5,9H.
The InChIKey is XWIYUCRMWCHYJR-UHFFFAOYSA-N.
The canonical SMILES is C1=CC2=C(C=CN2)N=C1.
The CAS number is 272-49-1.
The European Community (EC) number is 674-574-1.
The ChEMBL ID is CHEMBL5184883.
Yes, it is a canonicalized compound.