Trifluoromethanesulfonamide - CAS 421-85-2
Catalog: |
BB025073 |
Product Name: |
Trifluoromethanesulfonamide |
CAS: |
421-85-2 |
Synonyms: |
trifluoromethanesulfonamide |
IUPAC Name: | trifluoromethanesulfonamide |
Description: | Trifluoromethanesulfonamide (CAS# 421-85-2) is a useful synthetic intermediate. It is used to prepare specific inhibitors of mammalian secreted phospholipases A2. It is also used to synthesize ecicosanoids with effects on renal vasoconstriction. |
Molecular Weight: | 149.09 |
Molecular Formula: | CH2F3NO2S |
Canonical SMILES: | C(F)(F)(F)S(=O)(=O)N |
InChI: | InChI=1S/CH2F3NO2S/c2-1(3,4)8(5,6)7/h(H2,5,6,7) |
InChI Key: | KAKQVSNHTBLJCH-UHFFFAOYSA-N |
Boiling Point: | 164.6 °C at 760 mmHg |
Melting Point: | 120-124 °C (lit.) |
Purity: | 95 % |
Density: | 1.73 g/cm3 |
Appearance: | White solid |
MDL: | MFCD00068714 |
LogP: | 1.57580 |
GHS Hazard Statement: | H302 (92.06%): 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 |
WO-2015184256-A2 | Biodegradable lipids for delivery of nucleic acids | 20140530 |
WO-2015183727-A1 | Suspensions including organic bases for enhanced oil recovery and methods of obtaining hydrocarbons using such suspensions | 20140529 |
US-2015333371-A1 | Lithium titanate oxide as negative electrode in li-ion cells | 20140515 |
US-2015325831-A1 | Polyimide web separator for use in an electrochemical cell | 20140507 |
WO-2015168605-A1 | Methods for treatment of disorders in the front of the eye utilizing nucleic acid molecules | 20140501 |
PMID | Publication Date | Title | Journal |
22263894 | 20120308 | Cyclooxygenase-1-selective inhibitors based on the (E)-2'-des-methyl-sulindac sulfide scaffold | Journal of medicinal chemistry |
22259336 | 20120101 | Bis(tetra-phenyl-phospho-nium) bis-[N-(trifluoro-methyl-sulfon-yl)dithio-carbimato(2-)-κS,S']zincate(II) | Acta crystallographica. Section E, Structure reports online |
21555223 | 20110601 | Discovery of new chromone containing sulfonamides as potent inhibitors of bovine cytosolic carbonic anhydrase | Bioorganic & medicinal chemistry |
21804258 | 20110101 | Synthesis of N-[2-(2,4-Difluorophenoxy)trifluoromethyl-3-pyridyl]sulfonamides and their inhibitory activities against secretory phospholipase A₂ | Chemical & pharmaceutical bulletin |
20889345 | 20101101 | 4-[N-(substituted 4-pyrimidinyl)amino]benzenesulfonamides as inhibitors of carbonic anhydrase isozymes I, II, VII, and XIII | Bioorganic & medicinal chemistry |
Complexity: | 161 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 148.97583397 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 148.97583397 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 68.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.1 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Carbonyl Compounds
Sulfur Compounds
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS