CAS
60662-54-6 Purity
96%
60662-54-6 Purity
96%
If you have any other questions or need other size, please get a quote.
Specification
The molecular formula is C6H8NNaO5.
The molecular weight is 197.12 g/mol.
The IUPAC name is sodium;4-nitrophenolate;dihydrate.
The InChI is InChI=1S/C6H5NO3.Na.2H2O/c8-6-3-1-5(2-4-6)7(9)10;;;/h1-4,8H;;2*1H2/q;+1;;/p-1.
The InChIKey is ZJYUDTPVWWBKPV-UHFFFAOYSA-M.
The canonical SMILES is C1=CC(=CC=C1[N+](=O)[O-])[O-].O.O.[Na+].
The CAS number is 66924-59-2.
The European Community (EC) number is 632-899-6.
The hydrogen bond donor count is 2.
Yes, it is a canonicalized compound.