Diphenyl(trifluoromethyl)sulfonium Trifluoromethanesulfonate - CAS 147531-11-1
Catalog: |
BB010209 |
Product Name: |
Diphenyl(trifluoromethyl)sulfonium Trifluoromethanesulfonate |
CAS: |
147531-11-1 |
Synonyms: |
diphenyl(trifluoromethyl)sulfonium;trifluoromethanesulfonate; diphenyl(trifluoromethyl)sulfanium;trifluoromethanesulfonate |
IUPAC Name: | diphenyl(trifluoromethyl)sulfanium;trifluoromethanesulfonate |
Description: | Diphenyl(trifluoromethyl)sulfonium Trifluoromethanesulfonate (CAS# 147531-11-1) is a useful research chemical. |
Molecular Weight: | 404.35 |
Molecular Formula: | C14H10F6O3S2 |
Canonical SMILES: | C1=CC=C(C=C1)[S+](C2=CC=CC=C2)C(F)(F)F.C(F)(F)(F)S(=O)(=O)[O-] |
InChI: | InChI=1S/C13H10F3S.CHF3O3S/c14-13(15,16)17(11-7-3-1-4-8-11)12-9-5-2-6-10-12;2-1(3,4)8(5,6)7/h1-10H;(H,5,6,7)/q+1;/p-1 |
InChI Key: | YHEBUXDOUNWVNZ-UHFFFAOYSA-M |
Appearance: | Solid |
MDL: | MFCD12912173 |
LogP: | 5.37490 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P264, P270, P301+P317, P330, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-112979644-A | Method for preparing fluoromethylation indole [2,1, a ] isoquinoline derivative by using photocatalysis microchannel | 20210219 |
WO-2021074279-A1 | Spiro-fused tricyclic map4k1 inhibitors | 20191016 |
CN-110105277-B | Method for preparing 3, 4-dihydroquinoline-2 (1H) -ketone compound by using photocatalytic microchannel | 20190610 |
WO-2020016453-A1 | Substituted triazolo quinoxaline derivatives | 20180720 |
CN-112673009-A | Substituted triazoloquinoxaline derivatives | 20180720 |
Complexity: | 354 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 403.9975555 |
Formal Charge: | 0 |
Heavy Atom Count: | 25 |
Hydrogen Bond Acceptor Count: | 9 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 403.9975555 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 66.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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