CAS
2016-57-1 Purity
95%+
2016-57-1 Purity
95%+
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Specification
The molecular formula is C7H7ClN2O.
The molecular weight is 170.59 g/mol.
The IUPAC name is 4-amino-2-chlorobenzamide.
The InChI is InChI=1S/C7H7ClN2O/c8-6-3-4(9)1-2-5(6)7(10)11/h1-3H,9H2,(H2,10,11).
The InChIKey is XTCHLLLRWDYHRD-UHFFFAOYSA-N.
The canonical SMILES is C1=CC(=C(C=C1N)Cl)C(=O)N.
The CAS number is 211374-81-1.
The UNII is EN3579G41A.
The DSSTox Substance ID is DTXSID40465715.
Yes, the compound is canonicalized.