N-Fluorobenzenesulfonimide - CAS 133745-75-2
Catalog: |
BB007804 |
Product Name: |
N-Fluorobenzenesulfonimide |
CAS: |
133745-75-2 |
Synonyms: |
N-(benzenesulfonyl)-N-fluorobenzenesulfonamide |
Ordering Information
Catalog |
Size |
Price |
Stock |
BB007804 |
1 kg |
$298 |
In stock |
IUPAC Name: | N-(benzenesulfonyl)-N-fluorobenzenesulfonamide |
Description: | N-Fluorobenzenesulfonimide (CAS# 133745-75-2) is a mild electrophilic fluorinating reagent. |
Molecular Weight: | 315.34 |
Molecular Formula: | C12H10FNO4S2 |
Canonical SMILES: | C1=CC=C(C=C1)S(=O)(=O)N(F)S(=O)(=O)C2=CC=CC=C2 |
InChI: | InChI=1S/C12H10FNO4S2/c13-14(19(15,16)11-7-3-1-4-8-11)20(17,18)12-9-5-2-6-10-12/h1-10H |
InChI Key: | RLKHFSNWQCZBDC-UHFFFAOYSA-N |
Boiling Point: | 244.5 ℃ at 760 mmHg |
Melting Point: | 110-115 ℃ |
Purity: | 95 % |
Density: | 1.476 g/cm3 |
Appearance: | Off-white to light brown crystalline |
MDL: | MFCD00144885 |
LogP: | 4.11230 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-113307758-A | P2X7 receptor targeting probe precursor labeled by medical radioactive isotope | 20210610 |
CN-113292444-A | Multi-substituent-containing bia-dilute amide compound and preparation method thereof | 20210602 |
CN-113214179-A | Cu-catalyzed heteroatom alpha-position C-H activation method | 20210514 |
CN-113072470-A | N-acetonitrile bis-benzenesulfonylimine derivative and preparation method and application thereof | 20210330 |
CN-113072507-A | Preparation method of fluoropyrazine compound | 20210318 |
PMID | Publication Date | Title | Journal |
22822714 | 20120823 | Synthesis and evaluation of novel α-fluorinated (E)-3-((6-methylpyridin-2-yl)ethynyl)cyclohex-2-enone-O-methyl oxime (ABP688) derivatives as metabotropic glutamate receptor subtype 5 PET radiotracers | Journal of medicinal chemistry |
22252277 | 20120221 | Palladium-catalyzed allylic C-H amination of alkenes with N-fluorodibenzenesulfonimide: water plays an important role | Chemical communications (Cambridge, England) |
21174442 | 20110204 | Asymmetric synthesis of both mirror images of 3'-fluorothalidomide by enantiodivergent fluorination using a single, cinchona alkaloid | Organic letters |
22043253 | 20110101 | Development of the titanium-TADDOLate-catalyzed asymmetric fluorination of β-ketoesters | Beilstein journal of organic chemistry |
20931997 | 20101105 | Enantioselective synthesis of α-fluoro-β(3)-amino esters: synthesis of enantiopure, orthogonally protected α-fluoro-β(3)-lysine | The Journal of organic chemistry |
Complexity: | 461 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 315.00352831 |
Formal Charge: | 0 |
Heavy Atom Count: | 20 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 315.00352831 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 88.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.6 |
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