2-{[(Trifluoromethyl)sulfonyl]oxy}-1H-benzo[de]isoquinoline-1,3(2H)-dione | CAS No. 85342-62-7

2-{[(Trifluoromethyl)sulfonyl]oxy}-1H-benzo[de]isoquinoline-1,3(2H)-dione

Basic Information

CAS Number

85342-62-7

Molecular Formula

C13H6F3NO5S

Molecular Weight

345.25 g/mol

AD

Basic Physical Properties

Melting Point

212.1-214.2 °C

Solubility

PGMEA: 1%

c1cc2cccc3c2c(c1)C(=O)N(C3=O)OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C13H6F3NO5S/c14-13(15,16)23(20,21)22-17-11(18)8-5-1-3-7-4-2-6-9(10(7)8)12(17)19/h1-6H

InChIKey

LWHOMMCIJIJIGV-UHFFFAOYSA-N

LogP

2.2170000000000005

Topological Polar Surface Area

80.75 Ų

Hydrogen Bond Donor/Acceptor

0 / 6

Complexity

597

Synonyms & References

English

  • Methanesulfonic acid,1,1,1-trifluoro-, 1,3-dioxo-1H-benz[de]isoquinolin-2(3H)-yl ester
  • 1,3-Dioxo-1H-benzo[de]isoquinolin-2(3H)-yl trifluoromethanesulfonate
  • (1,3-dioxobenzo[de]isoquinolin-2-yl) trifluoromethanesulfonate
  • N-HYDROXYNAPHTHALIMIDE TRIFLATE
  • N-Hydroxynaphthalimide trifluoromethanesulfonate
  • HNT
  • NHN-TF
  • LWHOMMCIJIJIGV-UHFFFAOYSA-N
  • AK339582
  • 2-(((trifluoromethyl)sulfonyl)oxy)-1H-benz(de)isoquinoline-1,3(2H)-d

MDL Number

MFCD02683478

FAQ

What is 2-{[(Trifluoromethyl)sulfonyl]oxy}-1H-benzo[de]isoquinoline-1,3(2H)-dione (CAS: 85342-62-7)?

2-{[(Trifluoromethyl)sulfonyl]oxy}-1H-benzo[de]isoquinoline-1,3(2H)-dione (CAS: 85342-62-7) is a complex organic compound with a molecular formula C18H11F3NO5S. It is a derivative of benzoisoquinoline with a trifluoromethylsulfonyloxy group. This compound is used in pharmaceutical research and development for its potential biological activities.

What are the main uses of 2-{[(Trifluoromethyl)sulfonyl]oxy}-1H-benzo[de]isoquinoline-1,3(2H)-dione (CAS: 85342-62-7)?

2-{[(Trifluoromethyl)sulfonyl]oxy}-1H-benzo[de]isoquinoline-1,3(2H)-dione (CAS: 85342-62-7) is primarily used in pharmaceutical research for its potential anti-inflammatory and anti-tumor activities. It is also utilized in organic synthesis as a functional group for further chemical modifications.

Is 2-{[(Trifluoromethyl)sulfonyl]oxy}-1H-benzo[de]isoquinoline-1,3(2H)-dione (CAS: 85342-62-7) safe?

2-{[(Trifluoromethyl)sulfonyl]oxy}-1H-benzo[de]isoquinoline-1,3(2H)-dione (CAS: 85342-62-7) is considered safe when handled with proper precautions. It is important to wear protective gloves and goggles, and to avoid skin contact and inhalation. Store in a cool, dry place away from direct sunlight and heat sources.

How should 2-{[(Trifluoromethyl)sulfonyl]oxy}-1H-benzo[de]isoquinoline-1,3(2H)-dione (CAS: 85342-62-7) be stored?

2-{[(Trifluoromethyl)sulfonyl]oxy}-1H-benzo[de]isoquinoline-1,3(2H)-dione (CAS: 85342-62-7) should be stored in a cool, dry place, away from direct sunlight and heat sources. Maintain humidity below 50% and store in a tightly sealed container. It should be kept out of reach of children and away from flammable materials.

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