CAS 893-33-4 | 4,4,4-Trifluoro-1-(naphthalen-2-yl)butane-1,3-dione | CAS Number 893-33-4

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893-33-4 | 4,4,4-Trifluoro-1-(naphthalen-2-yl)butane-1,3-dione

CAS No: 893-33-4 Catalog No: AG003KCT MDL No:MFCD00054501

Product Description

Catalog Number:

AG003KCT

Chemical Name:

4,4,4-Trifluoro-1-(naphthalen-2-yl)butane-1,3-dione

CAS Number:

893-33-4

Molecular Formula:

C14H9F3O2

Molecular Weight:

266.2153

MDL Number:

MFCD00054501

IUPAC Name:

4,4,4-trifluoro-1-naphthalen-2-ylbutane-1,3-dione

InChI:

InChI=1S/C14H9F3O2/c15-14(16,17)13(19)8-12(18)11-6-5-9-3-1-2-4-10(9)7-11/h1-7H,8H2

InChI Key:

WVVLURYIQCXPIV-UHFFFAOYSA-N

SMILES:

O=C(C(F)(F)F)CC(=O)c1ccc2c(c1)cccc2

NSC Number:

42790

Properties

Complexity:

362

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

266.055g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

266.219g/mol

Monoisotopic Mass:

266.055g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

34.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.8

Literature

Title	Journal
Propyl-ammonium 4,4,4-trifluoro-1-(naphthalen-2-yl)butane-1,3-dionate.	Acta crystallographica. Section E, Structure reports online 20111201
Equilibrium and ab initio computational studies on the adduct formation of 1,3-diketonato-lithium(I), -sodium(I) and -potassium(I) with 1,10-phenanthroline and its 2,9-dimethyl derivatives.	Talanta 20090615
Liposome-based homogeneous luminescence resonance energy transfer.	Analytical biochemistry 20090115
Synthesis, characterization, and application of Eu(III), Tb(III), Sm(III), and Dy(III) lanthanide chelate nanoparticle labels.	Analytical chemistry 20050415