Cas no 129212-12-0 (Benzenesulfonic acid,5-[2-(2-hydroxy-1-naphthalenyl)diazenyl]-2-methyl-, barium salt (2:1))
![Benzenesulfonic acid,5-[2-(2-hydroxy-1-naphthalenyl)diazenyl]-2-methyl-, barium salt (2:1) structure](https://ossimg.kuujia.com/scimg/129500/129212-12-0x500.png)
129212-12-0 structure
Product Name:Benzenesulfonic acid,5-[2-(2-hydroxy-1-naphthalenyl)diazenyl]-2-methyl-, barium salt (2:1)
CAS No:129212-12-0
MF:C34H26BaN4O8S2
MW:820.049241542816
CID:235307
PubChem ID:136192409
Update Time:2025-04-19
Benzenesulfonic acid,5-[2-(2-hydroxy-1-naphthalenyl)diazenyl]-2-methyl-, barium salt (2:1) Chemical and Physical Properties
Names and Identifiers
-
- Benzenesulfonic acid,5-[2-(2-hydroxy-1-naphthalenyl)diazenyl]-2-methyl-, barium salt (2:1)
- Benzenesulfonic acid, 5-((2-hydroxy-1-naphthalenyl)azo)-2-methyl-, barium salt (2:1)
- barium(2+),2-methyl-5-[(2Z)-2-(2-oxonaphthalen-1-ylidene)hydrazinyl]benzenesulfonate
- Benzenesulfonic acid, 5-[(2-hydroxy-1-naphthalenyl)azo]-2-methyl-, barium salt (2:1)
- 129212-12-0
-
- Inchi： 1S/2C17H14N2O4S.Ba/c2*1-11-6-8-13(10-16(11)24(21,22)23)18-19-17-14-5-3-2-4-12(14)7-9-15(17)20;/h2*2-10,20H,1H3,(H,21,22,23);/q;;+2/p-2/b2*19-18+;
- InChI Key： IGPBASFMWFKWLI-VFUQPONKSA-L
- SMILES： [Ba+2].S(C1C=C(C=CC=1C)/N=N/C1C(=CC=C2C=CC=CC2=1)O)(=O)(=O)[O-].S(C1C=C(C=CC=1C)/N=N/C1C(=CC=C2C=CC=CC2=1)O)(=O)(=O)[O-]
Computed Properties
- Exact Mass: 820.024
- Monoisotopic Mass: 820.024
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 12
- Heavy Atom Count: 49
- Rotatable Bond Count: 4
- Complexity: 637
- Covalently-Bonded Unit Count: 3
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 2
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 214A^2
Benzenesulfonic acid,5-[2-(2-hydroxy-1-naphthalenyl)diazenyl]-2-methyl-, barium salt (2:1) Related Literature
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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