Cas no 2429-75-6 (Direct Violet 12)
Direct Violet 12 structure
Product Name:Direct Violet 12
CAS No:2429-75-6
MF:C32H22N6Na2O8S2
MW:728.662025928497
CID:84314
PubChem ID:101586783
Update Time:2025-04-18
Direct Violet 12 Chemical and Physical Properties
Names and Identifiers
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- Direct Violet 12
- 2-Naphthalenesulfonic acid, 3,3'-((1,1'-biphenyl)-4,4'-diylbis(azo))bis(7-amino-4-hydroxy-, disodium salt
- 2-Naphthalenesulfonic acid, 3,3'-[[1,1'-biphenyl]-4,4'-diylbis(azo)]bis[7-amino-4-hydroxy-, disodium salt
- 2429-75-6
-
- Inchi： 1S/C32H24N6O8S2.2Na/c33-21-5-11-25-19(13-21)15-27(47(41,42)43)29(31(25)39)37-35-23-7-1-17(2-8-23)18-3-9-24(10-4-18)36-38-30-28(48(44,45)46)16-20-14-22(34)6-12-26(20)32(30)40;;/h1-16,39-40H,33-34H2,(H,41,42,43)(H,44,45,46);;/q;2*+1/p-2/b37-35+,38-36+;;
- InChI Key： SLBQSDSILYKYBX-HKXUKFGYSA-L
- SMILES： S(C1C(=C(C2C=CC(=CC=2C=1)N)[O-])/N=N/C1C=CC(=CC=1)C1C=CC(=CC=1)/N=N/C1=C(C2C=CC(=CC=2C=C1S(=O)(=O)O)N)[O-])(=O)(=O)O.[Na+].[Na+]
Computed Properties
- Exact Mass: 728.07386
- Monoisotopic Mass: 728.07359259g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 14
- Heavy Atom Count: 50
- Rotatable Bond Count: 7
- Complexity: 1270
- Covalently-Bonded Unit Count: 3
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 273?2
Experimental Properties
- PSA: 256.34
- LogP: 11.76020
Direct Violet 12 Related Literature
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1. Estimating and correcting interference fringes in infrared spectra in infrared hyperspectral imagingGhazal Azarfar,Ebrahim Aboualizadeh,Nicholas M. Walter,Simona Ratti,Camilla Olivieri,Alessandra Norici,Michael Nasse,Achim Kohler,Mario Giordano Analyst, 2018,143, 4674-4683
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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