The Solvent Violet 8 with the cas number 52080-58-7 is also called C.I. Solvent Violet 8. The IUPAC name is 4-[(4-dimethylaminophenyl)-(4-methyliminocyclohexa-2,5-dien-1-ylidene)methyl]-N,N-dimethylaniline. Its molecular formula is C24H27N3. This substance is identified in the COLOUR INDEX by Colour Index Constitution Number, C.I. 42535:1.
Properties Computed from Structure: (1)XLogP3-AA: 5; (2)H-Bond Donor: 0; (3)H-Bond Acceptor: 3; (4)Rotatable Bond Count: 4; (5)Exact Mass: 357.220498; (6)MonoIsotopic Mass: 357.220498; (7)Topological Polar Surface Area: 18.8; (8)Heavy Atom Count: 27; (9)Formal Charge: 0; (10)Complexity: 560; (11)Isotope Atom Count: 0; (12)Defined Atom StereoCenter Count: 0; (13)Undefined Atom StereoCenter Count: 0; (14)Defined Bond StereoCenter Count: 0; (15)Undefined Bond StereoCenter Count: 0; (16)Covalently-Bonded Unit Count: 1.
You can still convert the following datas into molecular structure:
(1)SMILES: c1c(ccc(c1)/C(=C1\C=C/C(=N\C)C=C1)c1ccc(cc1)N(C)C)N(C)C
(2)InChI: InChI=1S/C24H27N3/c1-25-21-12-6-18(7-13-21)24(19-8-14-22(15-9-19)26(2)3)20-10-16-23(17-11-20)27(4)5/h6-17H,1-5H3
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