3,3'-Sulfonyldianiline
Product Information
Molecular Formula
C12H12N2O2S
Molecular Weight
248.30
Description
3,3'-Sulfonyldianiline is an impurity of Dapsone, an antibacterial used in the treatment of dermatitis herpetiformis.
Synonyms
Bis(3-aminophenyl) Sulfone; 3,3'-Diaminodiphenyl sulfone
IUPAC Name
3-(3-aminophenyl)sulfonylaniline
SMILES
C1=CC(=CC(=C1)S(=O)(=O)C2=CC=CC(=C2)N)N
InChI
InChI=1S/C12H12N2O2S/c13-9-3-1-5-11(7-9)17(15,16)12-6-2-4-10(14)8-12/h1-8H,13-14H2
InChI Key
LJGHYPLBDBRCRZ-UHFFFAOYSA-N
Boiling Point
542.8±35.0 °C (Predicted)
Melting Point
170-173 °C (lit.)
Purity
> 98.0 % (T)
Density
1.361 g/cm3
Appearance
White to slightly yellow fine crystalline powder
Storage
Store below +30 °C.
Refractive Index
1.5950 (estimate)
LogP
3.92700
Safety Information
Hazards
H302 - H373 - H411
Precautionary Statement
P260, P261, P264, P270, P271, P273, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P309+P311, P312, P314, P321, P330, P332+P313, P337+P313, P362, P391, P403+P233, P405, and P501
Signal Word
Warning
Computed Properties
XLogP3
1
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
2
Exact Mass
248.06194880 g/mol
Monoisotopic Mass
248.06194880 g/mol
Topological Polar Surface Area
94.6Ų
Heavy Atom Count
17
Formal Charge
0
Complexity
322
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
Patents
| Publication Number | Title | Priority Date |
|---|---|---|
| CN-114044901-A | Polyimide material and preparation method and application thereof | 2021-12-14 |
| CN-114053890-A | High-performance alkali-resistant nanofiltration membrane and preparation method thereof | 2021-12-09 |
| CN-114133702-A | High-temperature-resistant epoxy body suitable for RTM (resin transfer molding) and preparation method thereof | 2021-12-07 |
| CN-114031747-A | Low-viscosity high-performance epoxy resin system easy for dispersing nano materials and preparation method thereof | 2021-12-06 |
| CN-114044928-A | Preparation method of non-fluorine polyimide film with high visible light transmittance | 2021-12-02 |
| JP-2022043096-A | Resin composition, method for manufacturing cured relief pattern, and semiconductor device | 2021-12-01 |
| JP-2022010104-A | Polyamide-imide resin composition, fluorine paint, and conductive composition | 2021-11-05 |
| CN-114106324-A | Polyamide acid solution and preparation method and application thereof | 2021-10-25 |
| CN-113801437-A | Wave-absorbing epoxy resin, wave-absorbing epoxy resin composite material and preparation method thereof | 2021-10-21 |
| CN-113897025-A | Benzoxazine resin-based composition for packaging third-generation semiconductor device and preparation method thereof | 2021-09-24 |
Literatures
| PMID | Publication Date | Title | Journal |
|---|---|---|---|
| 23015826 | 2012-01-01 | Synthesis and characterization of a novel carboxyl group containing (co)polyimide with sulfur in the polymer backbone | Beilstein journal of organic chemistry |
| 22121724 | 2011-07-01 | Colorless and transparent polyimide nanocomposite films containing organoclay | Journal of nanoscience and nanotechnology |
| 20634124 | 2010-10-01 | Fluorimetric and prototropic studies on the inclusion complexation of 3,3'-diaminodiphenylsulphone with beta-cyclodextrin and its unusual behavior | Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy |
| 21581840 | 2009-01-08 | 3-(3-Amino-phenyl-sulfon-yl)aniline | Acta crystallographica. Section E, Structure reports online |
| 21203099 | 2008-07-05 | Bis(3-nitro-phen-yl) sulfone | Acta crystallographica. Section E, Structure reports online |
| 21202649 | 2008-05-21 | Bis(3-amino-phen-yl) sulfone acetonitrile solvate | Acta crystallographica. Section E, Structure reports online |
| 15962942 | 2005-06-01 | Prediction of genotoxicity of chemical compounds by statistical learning methods | Chemical research in toxicology |
| 15063349 | 2004-04-25 | Determination of 1-(3-fluoro-4-hydroxy-5-mercaptomethyltetrahydrofuran-2-yl)-5-methyl-1H-pyrimidine-2,4-dione in rat plasma and urine by high-performance liquid chromatography | Journal of chromatography. B, Analytical technologies in the biomedical and life sciences |
| 12832128 | 2003-06-01 | Synthesis and evaluation of analogues of Congo red as potential compounds against transmissible spongiform encephalopathies | European journal of medicinal chemistry |
