3051-11-4 Purity
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The molecular formula of Direct Blue 71 is C40H23N7Na4O13S4.
The molecular weight of Direct Blue 71 is 1029.9 g/mol.
Some synonyms for Direct Blue 71 include 4399-55-7, DIRECTBLUE71, and C.I. Direct Blue 71.
Direct Blue 71 was created on July 19, 2005, and last modified on December 23, 2023.
The IUPAC name of Direct Blue 71 is tetrasodium;3-[[4-[[4-[(6-amino-1-hydroxy-3-sulfonatonaphthalen-2-yl)diazenyl]-6-sulfonatonaphthalen-1-yl]diazenyl]naphthalen-1-yl]diazenyl]naphthalene-1,5-disulfonate.
The Canonical SMILES for Direct Blue 71 is C1=CC=C2C(=C1)C(=CC=C2N=NC3=CC4=C(C=CC=C4S(=O)(=O)[O-])C(=C3)S(=O)(=O)[O-])N=NC5=C6C=CC(=CC6=C(C=C5)N=NC7=C(C=C8C=C(C=CC8=C7O)N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]
Other identifiers for Direct Blue 71 include CAS numbers 4399-55-7 and 75627-20-2.
Some computed properties of Direct Blue 71 include a hydrogen bond donor count of 2, a hydrogen bond acceptor count of 20, and a rotational bond count of 6.
The exact mass of Direct Blue 71 is 1028.9827456 g/mol, and the topological polar surface area is 383 Å2.
The formal charge of Direct Blue 71 is 0, and the complexity is 2160.