21080-92-2 Purity
0.97
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Specification
The molecular formula is C8H5LiO7S.
The molecular weight is 252.2 g/mol.
The IUPAC name is lithium;3-carboxy-5-sulfobenzoate.
The InChI key is GGKPBCOOXDBLLG-UHFFFAOYSA-M.
The canonical SMILES is [Li+].C1=C(C=C(C=C1C(=O)[O-])S(=O)(=O)O)C(=O)O.
The CAS number is 46728-75-0.
The EC number is 256-275-4.
The ChEMBL ID is CHEMBL3188259.
The hydrogen bond donor count is 2.
The hydrogen bond acceptor count is 7.
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