Cas no 6470-20-8 (Acid Orange 56)
Acid Orange 56 structure
Product Name:Acid Orange 56
CAS No:6470-20-8
MF:C32H22N6Na2O8S2
MW:728.662025928497
CID:46797
PubChem ID:145868
Update Time:2025-04-18
Acid Orange 56 Chemical and Physical Properties
Names and Identifiers
-
- Acid Orange 56
- ACID ORANGE 56,CINO.ORANGE 56
- disodium,2-[4-[(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)diazenyl]-2-sulfonatophenyl]-5-[(2Z)-2-(2-oxonaphthalen-1-ylidene)hydrazinyl]benzenesulfonate
- (1,1'-Biphenyl)-2,2'-disulfonic acid,4-((4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo)-4'-((2-hydroxy-1-naphthalenyl)azo)-,disodium salt
- C.I. Acid Orange 56
- Disodium 4-((4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo)-4'-((2-hydroxy-1-naphthyl)azo)(1,1'-biphenyl)-2,2'-disulphonate
- EINECS 229-294-0
- Kayanol milling rrange g
- 1'-biphenyl]-2,2'-disulfonic acid,4-[(4,5-dihydro-3-methyl-5-oxo-1-phenyl-1h-pyrazol-4-yl)azo]-4'-[(2-hydroxy-1-naphthalenyl)azo]-[ disodium salt
- Disodium 4-[(4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo]-4'-[(2-hydroxy-1-naphthyl)azo][1,1'-biphenyl]-2,2'-disulphonate
- NS00047802
- 6470-20-8
- DTXSID80889552
- Acid Orange 56
- (1,1'-Biphenyl)-2,2'-disulfonic acid, 4-(2-(4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)diazenyl)-4'-(2-(2-hydroxy-1-naphthalenyl)diazenyl)-, sodium salt (1:2)
- [1,1'-Biphenyl]-2,2'-disulfonic acid, 4-[2-(4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)diazenyl]-4'-[2-(2-hydroxy-1-naphthalenyl)diazenyl]-, sodium salt (1:2)
- disodium;2-[4-[(2-hydroxynaphthalen-1-yl)diazenyl]-2-sulfonatophenyl]-5-[(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)diazenyl]benzenesulfonate
- C.I.Acid Orange 56
- (1,1'-Biphenyl)-2,2'-disulfonic acid, 4-((4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo)-4'-((2-hydroxy-1-naphthalenyl)azo)-, disodium salt
-
- Inchi: 1S/C32H24N6O8S2.2Na/c1-19-30(32(40)38(37-19)23-8-3-2-4-9-23)35-33-21-12-14-25(28(17-21)47(41,42)43)26-15-13-22(18-29(26)48(44,45)46)34-36-31-24-10-6-5-7-20(24)11-16-27(31)39;;/h2-18,30,39H,1H3,(H,41,42,43)(H,44,45,46);;/q;2*+1/p-2/b35-33+,36-34+;;
- InChI Key: JCGDEGCAEZOBSD-UUIOKUIJSA-L
- SMILES: S(C1C=C(C=CC=1C1C=CC(=CC=1S(=O)(=O)[O-])/N=N/C1=C(C=CC2C=CC=CC=21)O)/N=N/C1C(N(C2C=CC=CC=2)N=C1C)=O)(=O)(=O)[O-].[Na+].[Na+]
Computed Properties
- Exact Mass: 728.07400
- Monoisotopic Mass: 728.073592
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 13
- Heavy Atom Count: 50
- Rotatable Bond Count: 6
- Complexity: 1550
- Covalently-Bonded Unit Count: 3
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 230
Experimental Properties
- PSA: 233.50000
- LogP: 7.97320
Acid Orange 56 Related Literature
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Philipp Traber,Stephan Kupfer,Stefanie Gr?fe,Isabelle Baussanne,Martine Demeunynck,Jean-Marie Mouesca,Serge Gambarelli,Vincent Artero,Murielle Chavarot-Kerlidou Chem. Sci., 2018,9, 4152-4159
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Mark D. Allendorf,Alauddin Ahmed,Tom Autrey,Jeffrey Camp,Eun Seon Cho,Maciej Haranczyk,Abhi Karkamkar,Di-Jia Liu,Katie R. Meihaus,Iffat H. Nayyar,Roman Nazarov,Donald J. Siegel,Vitalie Stavila,Jeffrey J. Urban,Srimukh Prasad Veccham,Brandon C. Wood Energy Environ. Sci., 2018,11, 2784-2812
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Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
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Luke L. Lairson,Warren W. Wakarchuk Chem. Commun., 2007, 365-367
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Robert J. Meagher,Anson V. Hatch,Ronald F. Renzi,Anup K. Singh Lab Chip, 2008,8, 2046-2053
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