4,4,4-Trifluoro-1-(2-naphthyl)-1,3-butanedione - CAS 893-33-4
Catalog: |
BB039428 |
Product Name: |
4,4,4-Trifluoro-1-(2-naphthyl)-1,3-butanedione |
CAS: |
893-33-4 |
Synonyms: |
4,4,4-trifluoro-1-(2-naphthalenyl)butane-1,3-dione; 4,4,4-trifluoro-1-naphthalen-2-ylbutane-1,3-dione |
IUPAC Name: | 4,4,4-trifluoro-1-naphthalen-2-ylbutane-1,3-dione |
Description: | 4,4,4-Trifluoro-1-(2-naphthyl)-1,3-butanedione (CAS# 893-33-4) is a useful fluorescent compound. |
Molecular Weight: | 266.22 |
Molecular Formula: | C14H9F3O2 |
Canonical SMILES: | C1=CC=C2C=C(C=CC2=C1)C(=O)CC(=O)C(F)(F)F |
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 |
Boiling Point: | 347.7 °C at 760 mmHg |
Density: | 1.362 g/cm3 |
MDL: | MFCD00054501 |
LogP: | 3.54400 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
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PMID | Publication Date | Title | Journal |
22302597 | 20120501 | Fluorescence and electrochemical recognition of nucleosides and DNA by a novel luminescent bioprobe Eu(III)-TNB | Journal of fluorescence |
22199875 | 20111201 | Propyl-ammonium 4,4,4-trifluoro-1-(naphthalen-2-yl)butane-1,3-dionate | Acta crystallographica. Section E, Structure reports online |
19362187 | 20090615 | 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 |
18926790 | 20090115 | Liposome-based homogeneous luminescence resonance energy transfer | Analytical biochemistry |
15828805 | 20050415 | Synthesis, characterization, and application of Eu(III), Tb(III), Sm(III), and Dy(III) lanthanide chelate nanoparticle labels | Analytical chemistry |
Complexity: | 362 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 266.05546401 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 266.05546401 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 34.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.8 |
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