Diphenyl sulfone - CAS 127-63-9
Catalog: |
BB006815 |
Product Name: |
Diphenyl sulfone |
CAS: |
127-63-9 |
Synonyms: |
benzenesulfonylbenzene |
IUPAC Name: | benzenesulfonylbenzene |
Description: | Phenyl Sulphone undergoes deoxygenation with Mg-MeOH at room temperature. |
Molecular Weight: | 218.27 |
Molecular Formula: | C12H10O2S |
Canonical SMILES: | C1=CC=C(C=C1)S(=O)(=O)C2=CC=CC=C2 |
InChI: | InChI=1S/C12H10O2S/c13-15(14,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H |
InChI Key: | KZTYYGOKRVBIMI-UHFFFAOYSA-N |
Boiling Point: | 379 °C |
Melting Point: | 125-129 °C |
Purity: | 97 % |
Density: | 377 |
Appearance: | White crystalline powder |
Storage: | Keep container closed when not in use. Store in a cool, dry, well-ventilated area away from incompatible substances. |
MDL: | MFCD00007548 |
LogP: | 3.60020 |
Vapor Pressure: | 0.0000153 [mmHg] |
GHS Hazard Statement: | H302 (99.23%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
US-2020395554-A1 | Compound and organic electro-optical device containing the same | 20200515 |
US-10993764-B1 | Insulating grips for minimally invasive surgical instruments | 20200114 |
EP-3841987-A1 | Customized patient-specific contact segments for orthopaedic surgical instrument using bone silhouette curves | 20191228 |
US-2021186422-A1 | Implantable medical device with metal and polymer housing | 20191220 |
US-2021186477-A1 | Retractor Members, And Related Systems And Methods | 20191220 |
PMID | Publication Date | Title | Journal |
22309915 | 20120301 | New heterocyclic compounds from 1,2,4-triazole and 1,3,4-thiadiazole class bearing diphenylsulfone moieties. Synthesis, characterization and antimicrobial activity evaluation | European journal of medicinal chemistry |
22226656 | 20120201 | Discovery of 7-arylsulfonyl-1,2,3,4, 4a,9a-hexahydro-benzo[4,5]furo[2,3-c]pyridines: identification of a potent and selective 5-HT₆ receptor antagonist showing activity in rat social recognition test | Bioorganic & medicinal chemistry letters |
21723178 | 20120101 | Ultrasound assisted one-pot, three-components synthesis of pyrimido[1,2-a]benzimidazoles and pyrazolo[3,4-b]pyridines: A new access via phenylsulfone synthon | Ultrasonics sonochemistry |
22607449 | 20120101 | HiTSEE KNIME: a visualization tool for hit selection and analysis in high-throughput screening experiments for the KNIME platform | BMC bioinformatics |
21988286 | 20111201 | Comparison of migration from polyethersulphone and polycarbonate baby bottles | Food additives & contaminants. Part A, Chemistry, analysis, control, exposure & risk assessment |
Complexity: | 253 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 218.04015073 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 218.04015073 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 42.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.4 |
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