Cas no 5873-20-1 (2-Naphthalenesulfonicacid,7-[(aminocarbonyl)amino]-4-hydroxy-3-[2-[4-[2-(4-sulfophenyl)diazenyl]phenyl]diazenyl]-,sodium salt (1:2))
5873-20-1 structure
Product Name:2-Naphthalenesulfonicacid,7-[(aminocarbonyl)amino]-4-hydroxy-3-[2-[4-[2-(4-sulfophenyl)diazenyl]phenyl]diazenyl]-,sodium salt (1:2)
CAS No:5873-20-1
MF:C23H16N6Na2O8S2
MW:614.518083572388
CID:375809
PubChem ID:135755581
Update Time:2025-04-19
2-Naphthalenesulfonicacid,7-[(aminocarbonyl)amino]-4-hydroxy-3-[2-[4-[2-(4-sulfophenyl)diazenyl]phenyl]diazenyl]-,sodium salt (1:2) Chemical and Physical Properties
Names and Identifiers
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- 2-Naphthalenesulfonicacid,7-[(aminocarbonyl)amino]-4-hydroxy-3-[2-[4-[2-(4-sulfophenyl)diazenyl]phenyl]diazenyl]-,sodium salt (1:2)
- disodium 7-[(aminocarbonyl)amino]-4-hydroxy-3-[[4-[(4-sulphonatophenyl)azo]phenyl]azo]naphthalene-2-sulphonate
- disodium,(3E)-7-(carbamoylamino)-4-oxo-3-[[4-[(4-sulfonatophenyl)diazenyl]phenyl]hydrazinylidene]naphthalene-2-sulfonate
- 2-Naphthalenesulfonic acid, 7-((aminocarbonyl)amino)-4-hydroxy-3-((4-((4-sulfophenyl)azo)phenyl)azo)-, disodium salt
- disodium (3E)-7-(carbamoylamino)-4-oxo-3-(2-{4-[(E)-(4-sulfonatophenyl)diazenyl]phenyl}hydrazinylidene)-3,4-dihydronaphthalene-2-sulfonate
- Disodium 7-((aminocarbonyl)amino)-4-hydroxy-3-((4-((4-sulphonatophenyl)azo)phenyl)azo)naphthalene-2-sulphonate
- Dianil Fast Red 6BL
- Disodium 7-[(aminocarbonyl)amino]-4-hydroxy-3-[[4-[(4-sulfonatophenyl)azo]phenyl]azo]naphthalene-2-sulfonate
- DTXSID4031859
- 5873-20-1
- NS00046073
- EINECS 227-530-7
-
- Inchi: 1S/C23H18N6O8S2.2Na/c24-23(31)25-17-7-10-19-13(11-17)12-20(39(35,36)37)21(22(19)30)29-28-15-3-1-14(2-4-15)26-27-16-5-8-18(9-6-16)38(32,33)34;;/h1-12,30H,(H3,24,25,31)(H,32,33,34)(H,35,36,37);;/q;2*+1/p-2/b27-26+,29-28+;;
- InChI Key: UCIAVFMGTWNMHG-AESVWCPUSA-L
- SMILES: S(C1C(=C(C2C=CC(=CC=2C=1)NC(N)=O)O)/N=N/C1C=CC(=CC=1)/N=N/C1C=CC(=CC=1)S(=O)(=O)[O-])(=O)(=O)[O-].[Na+].[Na+]
Computed Properties
- Exact Mass: 614.02688
- Monoisotopic Mass: 614.027
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 12
- Heavy Atom Count: 41
- Rotatable Bond Count: 5
- Complexity: 1210
- Covalently-Bonded Unit Count: 3
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- Surface Charge: 0
- Tautomer Count: 66
- XLogP3: nothing
- Topological Polar Surface Area: 253A^2
Experimental Properties
- PSA: 239.19
2-Naphthalenesulfonicacid,7-[(aminocarbonyl)amino]-4-hydroxy-3-[2-[4-[2-(4-sulfophenyl)diazenyl]phenyl]diazenyl]-,sodium salt (1:2) Related Literature
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Ravi Kumar Yadav,R. Govindaraj Phys. Chem. Chem. Phys., 2020,22, 26876-26886
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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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Xiang Liu,Qian Sun,A. B. Djuri?i?,Maohai Xie,Baohu Dai,Jinyao Tang,Charles Surya,Changzhong Liao,Kaimin Shih RSC Adv., 2015,5, 100783-100789
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Hailing Chen,Lu Yin,Meng Liu,Laibing Wang,Michiya Fujiki,Wei Zhang RSC Adv., 2019,9, 4849-4856
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Priyambada Nayak,Tanmaya Badapanda,Anil Kumar Singh,Simanchalo Panigrahi RSC Adv., 2017,7, 16319-16331
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