Cas no 6288-06-8 ( )
structure
Product Name:
CAS No:6288-06-8
MF:C13H10N4O6S
MW:350.306701183319
CID:958191
PubChem ID:9561060
Update Time:2025-04-19
Chemical and Physical Properties
Names and Identifiers
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- 4-Nitro-benzolsulfonsaeure-(2-nitro-benzylidenhydrazid); 4-nitro-benzenesulfonic acid-(2-nitro-benzylidenehydrazide); NSC12050; 4-(Hydroxy(oxido)amino)-N'-(2-(hydroxy(oxido)amino)benzylidene)benzenesulfonohydrazide;
- 4-(Hydroxy(oxido)amino)-N'-(2-(hydroxy(oxido)amino)benzylidene)benzenesulfonohydrazide
- NSC12050
- NSC-12050
- NSC 12050
- 4-nitro-N-[(E)-(2-nitrophenyl)methyleneamino]benzenesulfonamide
- 6288-06-8
-
-
- Inchi： 1S/C13H10N4O6S/c18-16(19)11-5-7-12(8-6-11)24(22,23)15-14-9-10-3-1-2-4-13(10)17(20)21/h1-9,15H/b14-9+
- InChI Key： WXFHZVPXVCAKMD-NTEUORMPSA-N
- SMILES： S(C1C=CC(=CC=1)[N+](=O)[O-])(N/N=C/C1C=CC=CC=1[N+](=O)[O-])(=O)=O
Computed Properties
- Exact Mass: 350.0322
- Monoisotopic Mass: 350.03210523g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 24
- Rotatable Bond Count: 4
- Complexity: 583
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.2
- Topological Polar Surface Area: 159?2
Experimental Properties
- PSA: 144.81
- LogP: 4.33350
Related Literature
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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Jason Wan Lab Chip, 2020,20, 4528-4538
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
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