52357-70-7 Purity
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Specification
The molecular formula of Lithol Rubin BCA is C18H12CaN2O6S.
The molecular weight of Lithol Rubin BCA is 424.4 g/mol.
The synonyms of Lithol Rubin BCA include 5281-04-9, D&C Red No. 7, Brilliant Carmine 6B, and Lithol Rubine BK.
The IUPAC name of Lithol Rubin BCA is calcium; 2-[(3-carboxy-2-oxidonaphthalen-1-yl)diazenyl]-5-methylbenzenesulfonate.
The InChIKey of Lithol Rubin BCA is PZTQVMXMKVTIRC-UHFFFAOYSA-L.
The Canonical SMILES of Lithol Rubin BCA is CC1=CC(=C(C=C1)N=NC2=C(C(=CC3=CC=CC=C32)C(=O)O)[O-])S(=O)(=O)[O-].[Ca+2].
The CAS number of Lithol Rubin BCA is 5281-04-9.
Lithol Rubin BCA has 1 hydrogen bond donor count.
Lithol Rubin BCA has 8 hydrogen bond acceptor counts.
The topological polar surface area of Lithol Rubin BCA is 151 Ų.