Compound: Solvent violet 13
SMILES: O=C1c2c(C(=O)c3c1cccc3)c(Nc4ccc(C)cc4)ccc2O
InChIKey: LJFWQNJLLOFIJK-UHFFFAOYSA-N
Synonyms: Solvent violet 13, 81-48-1, ALIZUROL PURPLE, D&C Violet 2, D&C Violet No. 2, 1-Hydroxy-4-(p-toluidino)anthraquinone, 12217-81-1, CI Disperse Blue 72, CI Solvent Violet 13, D & C Violet no. 2, Duranol Brilliant Violet 7G, CCRIS 7073, HSDB 1958, EINECS 201-353-5, UNII-350KA7O6HK, BRN 2163109, 9,10-Anthracenedione, 1-hydroxy-4-[(4-methylphenyl)amino]-, DTXSID1026293, AI3-16428, NSC-2856, MURASAKI201, 9,10-Anthracenedione, 1-hydroxy-4-((4-methylphenyl)amino)-, DC VIOLET NO. 2, SANDOPLAST VIOLET RSB, ALIZUROL PURPLE [HSDB], D & C VIOLET NO.2, DTXCID906293, Anthraquinone, 1-hydroxy-4-(p-toluidino)-, 4-14-00-00893 (Beilstein Handbook Reference), Resiren Blue TRP, Dispersol Violet BG, RefChem:184254, D+C VIOLET NO 2, VIOLET 2 [INCI], MURASAKI201 [INCI], D AND C VIOLET NO 2, 1Hydroxy4(ptoluidino)anthraquinone, 4Hydroxy1(ptoluidino)anthraquinone, Anthraquinone, 1hydroxy4ptoluidino, SOLVENT VIOLET 13 [INCI], N(4Hydroxy1anthraquinonyl)ptoluidine, N(pTolyl)4hydroxy1anthraquinonylamine, N(4Hydroxy1anthraquinonyl)4methylaniline, 1Hydroxy4((4methylphenyl)amino)9,10anthracenedione, 9,10Anthracenedione, 1hydroxy4((4methylphenyl)amino), 201-353-5, 601-910-6, LJFWQNJLLOFIJK-UHFFFAOYSA-N, VIOLET 2, Disperse Blue 72, 1-Hydroxy-4-(p-tolylamino)anthracene-9,10-dione, Quinizarin Blue, Irisol base, Resiren Blue TR, C.I. Solvent Violet 13, Waxoline Purple A, Resolin Blue RRL, Resorin Blue RRL, Sumikaron Violet B, Alizarine Irisol R Base, Resiren Blue TR-P, Alizarine Violet 3B Base, Dispersol Violet B-G, D+C Violet No. 2, 11092 Violet, Ahcoquinone Blue IR Base, 1-Hydroxy-4-p-toluidinoanthraquinone, D and C Violet No. 2, C.I. Disperse Blue 72, Duranol Brilliant Violet TG, Transetile Violet P 3B, C.I. 60725, 1-hydroxy-4-(4-methylanilino)anthracene-9,10-dione, 4-Hydroxy-1-(p-toluidino)anthraquinone, Modr disperzni 72, CI 60725, Anthraquinone, 1-hydroxy-4-p-toluidino-, Violet rozpoustedlova 13, NSC 2856, N-(4-Hydroxy-1-anthraquinonyl)-p-toluidine, N-(p-Tolyl)-4-hydroxy-1-anthraquinonylamine, N-(4-Hydroxy-1-anthraquinonyl)-4-methylaniline, MFCD00019148, 350KA7O6HK, NSC2856, 1-Hydroxy-4-((4-methylphenyl)amino)-9,10-anthracenedione, Modr Disperzni 72 [Czech], 1342-19-4, Violet rozpoustedlova 13 [Czech], D&C Violet No.2, SCHEMBL39659, orb1705776, orb3025937, CHEMBL3181893, SCHEMBL29353964, MSK5876, Tox21_202902, AKOS000668467, CS-W020930, 1-Hydroxy-4-(p-toluidine)anthraquinone, CAS-81-48-1, NCGC00260448-01, WLN: L C666 BV IVJ DQ GMR D1, 9, 1-hydroxy-4-[(4-methylphenyl)amino]-, NS00003750, Q0022, ST50553425, E83036, 1-Hydroxy-4-(4-toluidino)anthra-9,10-quinone #, F517793, Q7559031, 1-hydroxy-4-[(4-methylphenyl)amino]anthra-9,10-quinone, 4-hydroxy-1-[(4-methylphenyl)amino]anthracene-9,10-dione
Theoretical properties:
molecular_formula: C21H15NO3
molecular_weight: 329.3 g/mol
exact_mass: 329.10519334 g/mol
formal_charge: 0
hydrogen_bond_donor_count: 2
hydrogen_bond_acceptor_count: 4
rotatable_bond_count: 2
heavy_atom_count: 25
topological_polar_surface_area: 66.4 Å²
isotope_atom_count: 0
covalently_bonded_unit_count: 1
Physical properties:
Descriptions:
chembl: Unnamed Compound is a small molecule listed in the ChEMBL database but has not progressed to an approved clinical phase.
wikipedia: Solvent Violet 13, also known as D&C Violet No.2, oil violet, Solvent Blue 90, Alizarine Violet 3B, Alizurol Purple, Duranol Brilliant Violet TG, Ahcoquinone Blue IR base, Quinizarin Blue, Disperse Blue 72, and C.I. 60725, is a synthetic anthraquinone dye with bright bluish violet hue. It is a solid insoluble in water and soluble in acetone, toluene, and benzene. Its chemical formula is C21H15NO3, and its structure is 1-hydroxy-4-(p-tolylamino)anthraquinone, or 1-hydroxy-4-[(4-methylphenyl)amino]-9,10-anthracenedione or 1-hydroxy-4-(4-methylanilino)anthraquinone.
Solvent Violet 13 is used to dye hydrocarbon products like solvents and petrol, thermoplastics, synthetic resins, e.g. polystyrenes, and synthetic fiber. It is also used in cosmetics, e.g. in hair and skin care products. In pyrotechnics, it is used in some violet colored smoke compositions.