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Revision as of 12:50, 24 November 2011 editBeetstra (talk | contribs)Edit filter managers, Administrators172,031 edits Saving copy of the {{chembox}} taken from revid 418509543 of page Mordant_Brown_33 for the Chem/Drugbox validation project (updated: 'StdInChI', 'StdInChIKey').  Latest revision as of 19:23, 30 January 2024 edit Michael7604 (talk | contribs)Extended confirmed users8,895 edits recategorized 
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{{Refimprove|date=September 2015}}
{{ambox | text = This page contains a copy of the infobox ({{tl|chembox}}) taken from revid of page ] with values updated to verified values.}}
{{Chembox {{Chembox
| Verifiedfields = changed
| Watchedfields = changed | Watchedfields = changed
| verifiedrevid = 462253668
| ImageFile = Mordant Brown 33.png | ImageFile = Mordant Brown 33.png
| ImageSize = 200px | ImageSize = 200px
| ImageName = Wireframe model of a mordant brown 33 tautomer
| PIN = Mordant brown 33 | ImageName = Wireframe model of a mordant brown 33 tautomer
| PIN =
| SystematicName = Sodium 2,4-diamino-5-benzene-1-sulfonate | SystematicName = Sodium 2,4-diamino-5-benzene-1-sulfonate
| OtherNames = Chrome Brown RH<br />
Sodium 2,4-diamino-5-benzenesulfonate | OtherNames = Mordant brown 33<br />Chrome Brown RH<br />Sodium 2,4-diamino-5-benzenesulfonate
| Section1 = {{Chembox Identifiers |Section1={{Chembox Identifiers
| CASNo = 1082653-05-1
| Abbreviations = MB33
| CASNo_Ref = {{Cascite|changed|CAS}}
| PubChem = 24186234
| PubChem_Ref = {{Pubchemcite}} | CASNo1_Ref = {{cascite|correct|CAS}}
| CASNo1 = 3618-62-0
| PubChem1 = 9575826
| CASNo1_Comment = (non-specific)
| PubChem1_Comment = (1''E'')
| PubChem1_Ref = {{Pubchemcite}} | UNII_Ref = {{fdacite|correct|FDA}}
| UNII = HW6KSE69YM
| PubChem2 = 5483143
| DTXSID = DTXSID0063101
| PubChem2_Comment = (1''Z'')
| EINECS = 222-810-5
| PubChem2_Ref = {{Pubchemcite}}
<!--info card 100.020.737 https://echa.europa.eu/substance-information/-/substanceinfo/100.020.737-->
| InChIKey1 = CKWUOVPZRGZTSZ-QFHYWFJHSA-M
| Abbreviations = MB33
| PubChem = 135414428
| PubChem1 = 9575826
| PubChem1_Comment = (1''E'')
| PubChem2 = 5483143
| PubChem2_Comment = (1''Z'')
| InChIKey1 = CKWUOVPZRGZTSZ-QFHYWFJHSA-M
| ChemSpiderID = 7850278 | ChemSpiderID = 7850278
| ChemSpiderID_Comment = (1''E'') | ChemSpiderID_Comment = (1''E'')
| ChemSpiderID_Ref = {{Chemspidercite}} | ChemSpiderID_Ref = {{chemspidercite|correct|chemspider}}
| ChemSpiderID1_Ref = {{chemspidercite|correct|chemspider}}
| ChemSpiderID1 = 4588144
| ChemSpiderID1_Comment = (1''Z'') | ChemSpiderID1 = 4588144
| ChemSpiderID1_Comment = (1''Z'')
| InChI = 1S/C12H11N5O6S.Na/c13-7-4-8(14)12(24(21,22)23)5-9(7)15-16-10-3-6(17(19)20)1-2-11(10)18;/h1-5,15H,13-14H2,(H,21,22,23);/q;+1/p-1/b16-10+;
| ChemSpiderID1_Ref = {{Chemspidercite}}
| InChI = 1S/C12H11N5O6S.Na/c13-7-4-8(14)12(24(21,22)23)5-9(7)15-16-10-3-6(17(19)20)1-2-11(10)18;/h1-5,15H,13-14H2,(H,21,22,23);/q;+1/p-1/b16-10+;
| InChI1 = 1S/C12H11N5O6S.Na/c13-7-4-8(14)12(24(21,22)23)5-9(7)15-16-10-3-6(17(19)20)1-2-11(10)18;/h1-5,15H,13-14H2,(H,21,22,23);/q;+1/p-1/b16-10+; | InChI1 = 1S/C12H11N5O6S.Na/c13-7-4-8(14)12(24(21,22)23)5-9(7)15-16-10-3-6(17(19)20)1-2-11(10)18;/h1-5,15H,13-14H2,(H,21,22,23);/q;+1/p-1/b16-10+;
| SMILES = .O=C2/C=C\C(=C/C2=N\Nc1cc(c(N)cc1N)S()(=O)=O)()=O | SMILES = .O=C2/C=C\C(=C/C2=N\Nc1cc(c(N)cc1N)S()(=O)=O)()=O
| StdInChI_Ref = {{stdinchicite|changed|chemspider}}
| StdInChI = 1S/C12H11N5O6S.Na/c13-7-4-8(14)12(24(21,22)23)5-9(7)15-16-10-3-6(17(19)20)1-2-11(10)18;/h1-5,15H,13-14H2,(H,21,22,23);/q;+1/p-1/b16-10+; | StdInChI = 1S/C12H11N5O6S.Na/c13-7-4-8(14)12(24(21,22)23)5-9(7)15-16-10-3-6(17(19)20)1-2-11(10)18;/h1-5,15H,13-14H2,(H,21,22,23);/q;+1/p-1
| StdInChIKey = CKWUOVPZRGZTSZ-QFHYWFJHSA-M
| StdInChIKey_Ref = {{stdinchicite|changed|chemspider}}
}}
| StdInChIKey = CKWUOVPZRGZTSZ-UHFFFAOYSA-M}}
| Section2 = {{Chembox Properties
| C=12 | H=10 | N=5 | Na=1 | O=6 | S=1
}}
|Section7 = {{Chembox Hazards
| GHSPictograms = {{GHS05}}{{GHS07}}{{GHS08}}
| GHSSignalWord = Warning
| HPhrases = {{H-phrases|317|318|341}}
| PPhrases = {{P-phrases|201|202|261|272|280|281|302+352|305+351+338|308+313|310|321|333+313|363|405|501}}
}}
}} }}

'''Mordant brown 33''' ('''MB33''') is 2,4-diamino-5-(2-hydroxy-5-nitrophenylazo) ] ] ].

The ]-] of MB33 in all mixtures investigated display three ]s in 50% ] within all the pH ranges 1.5-13.3 using Thiel buffer the maximum absorption of these bands is located at 438, 453 and a double head band at 410 and 475&nbsp;nm . The band at 438&nbsp;nm corresponds to absorption attributed to the ] form (LH6) of MB33 (whereas L indicates to the parent structure of ] without ] ]s) and disappears at pH > 3.0. The band at 453&nbsp;nm corresponds to the absorption of the neutral form of the ] (LH5-). The double head bands at 410 and 475&nbsp;nm correspond to the di-anionic (LH<sub>4</sub><sup>2−</sup>) of MB33.<ref name=Seleim>M. M. Seleim, M. S. Abu-Bakr, E.Y. Hashem and A. M. El-Zohry; ; Canadian Journal of Analytical Sciences and Spectroscopy, Volume 54, No. 2, 2009. - '''www.researchgate.net'''</ref>

==References==
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