5-(Trifluoromethyl)benzofuran-3(2H)-one - CAS 1337847-19-4

Catalog:	BB007807
Product Name:	5-(Trifluoromethyl)benzofuran-3(2H)-one
CAS:	1337847-19-4
Synonyms:	5-(trifluoromethyl)-3-benzofuranone; 5-(trifluoromethyl)-1-benzofuran-3-one

Technical Data

Patents

Computed Properties

IUPAC Name:	5-(trifluoromethyl)-1-benzofuran-3-one
Description:	5-(Trifluoromethyl)benzofuran-3(2H)-one (CAS# 1337847-19-4 ) is a useful research chemical.
Molecular Weight:	202.13
Molecular Formula:	C9H5F3O2
Canonical SMILES:	C1C(=O)C2=C(O1)C=CC(=C2)C(F)(F)F
InChI:	InChI=1S/C9H5F3O2/c10-9(11,12)5-1-2-8-6(3-5)7(13)4-14-8/h1-3H,4H2
InChI Key:	DFSCMRNXVRDAPI-UHFFFAOYSA-N

Publication Number	Title	Priority Date
EP-2682272-B1	Ink jet recording method and printed material	20110228
US-9211725-B2	Inkjet recording method and printed material	20110228
EP-2145931-B1	Photo-curable composition, ink composition, and inkjet recording method using the ink composition	20080716
EP-2145932-A1	Aqueous ink composition, aqueous ink composition for inkjet recording, and inkjet recording method	20080716
EP-2154213-A1	Ink-jet ink composition, and ink-jet recording method	20080716

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Complexity:	249
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	202.02416388
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	202.02416388
Rotatable Bond Count:	0
Topological Polar Surface Area:	26.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.4