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Phenanthrene, 4a,4b-dihydro-, also known as a derivative of phenanthrene, is a chemical compound that falls under the category of polycyclic aromatic hydrocarbons (PAHs). It is an environmental contaminant that is formed from the incomplete combustion of organic materials and is known for its persistence and bioaccumulation in the environment. Due to its toxic and carcinogenic properties, it poses a significant risk to both human health and the environment.

13020-78-5

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13020-78-5 Usage

Uses

Phenanthrene, 4a,4b-dihydrois used as a research subject in environmental chemistry and toxicology for understanding its environmental behavior, impact, and potential mitigation strategies. The expression is:
Used in Environmental Chemistry and Toxicology Research:
Phenanthrene, 4a,4b-dihydrois used as a research subject for studying its environmental distribution, persistence, bioaccumulation, and toxicological effects, as well as for developing methods to reduce its environmental release and exposure.
Additionally, it may be used in the development of analytical methods for detecting and monitoring its presence in various environmental samples, such as air, water, and soil. The expression is:
Used in Analytical Chemistry:
Phenanthrene, 4a,4b-dihydrois used as a target analyte for developing and validating analytical methods to detect and quantify its presence in environmental samples, aiding in the assessment of its environmental distribution and potential risks.

Check Digit Verification of cas no

The CAS Registry Mumber 13020-78-5 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 1,3,0,2 and 0 respectively; the second part has 2 digits, 7 and 8 respectively.
Calculate Digit Verification of CAS Registry Number 13020-78:
(7*1)+(6*3)+(5*0)+(4*2)+(3*0)+(2*7)+(1*8)=55
55 % 10 = 5
So 13020-78-5 is a valid CAS Registry Number.

13020-78-5SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 20, 2017

Revision Date: Aug 20, 2017

1.Identification

1.1 GHS Product identifier

Product name 4a,4b-dihydrophenanthrene

1.2 Other means of identification

Product number -
Other names Phenanthrene,4a,4b-dihydro

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:13020-78-5 SDS

13020-78-5Upstream product

13020-78-5Relevant academic research and scientific papers

Photochemistry of Stilbene Adsorbed on Silica Gel and NaX Zeolite. A Diffuse Reflectance Laser Flash Photolysis Study

Lednev, I. K.,Mathivanan, N.,Johnston, L. J.

, p. 11444 - 11451 (2007/10/02)

Diffuse reflectance laser flash photolysis (266, 308, or 355 nm) of either cis- or trans-stilbene (St) adsorbed on silica gel or included in NaX zeolite leads to the formation of the trans-St radical cation with λmax at 475 nm at high laser powers.At low laser intensities trans-St also yields radical cation while cis-St photocyclizes to give dihydrophenanthrene with λmax at 450 nm.In contrast to the results for irradiation of stilbene alone on solid supports, irradiation of the cis-St/TNM charge transfer complex on silica or zeolite leads to a mixture of both trans- and cis-St.+ (λmax at 510 nm), demonstrating that the cis radical cation is stable with respect to isomerization on these two solids.This result, in combination with product studies which demonstrate that there is substantial cis-trans isomerization within a single laser pulse, leads to the conclusion that the formation of trans-St.+ following laser irradiation of cis-St occurs via cis-trans isomerization followed by photoionization of trans-St.Laser irradiation of St or pyrene on NaX zeolite results in strong transient signals in the 500-600 nm region due to trapped electrons, in addition to the signals due to radical cations.The effects of both water and oxygen on the trapped electron and radical cation have been examined.The trapped electron can be photobleached with a second 532 nm laser pulse.The bleaching does not lead either to trapping of the electron by ground state aromatic to give its radical anion or to recombination with the radical cation to regenerate the starting material.This suggests that irradiation leads to a redistribution of the electron to other zeolite sites.

Cis-stilbene isomerization: Temperature dependence and the role of mechanical friction

Todd, David C.,Fleming, Graham R.

, p. 269 - 279 (2007/10/02)

The fluorescence decay time of cis-stilbene has been measured in a variety of solvents over a large temperature range.An isoviscosity Arrhenius plot in n-alkanes yields an activation energy of 386+/-29 cm-1.We interpret this result as an upper limit for the cis-stilbene to trans-stilbene barrier in nonpolar solvents.Isoviscosity plots in small alcohols are nonlinear, indicating complicated behavior in this solvent type.The excited state decay times in n-alcohols and n-alkane solvents correlate well with each other when plotted as a function of chain length, n.We infer from this plot that macroscopic viscosity is a poor measure of the friction felt by the isomerizing species when changing solvent, and that the potential energy surface is not substantially altered between n-alkanes and n-alcohols with n 5.Decay times measured in 2-propanol at 490, 475, 453, and 440 nm emission differ by no more than 90 fs, indicating that there is little or no spectral evolution during the excited state lifetime.A short component in the fluorescence anisotropy decay of cis-stilbene and a decrease in the excited state lifetime due to deuterium substitution for the ethylenic hydrogens are observed in both polar and nonpolar solvents.Treating DHP formation as a thermally activated process which competes with the cis to trans isomerization, we determine a range of model dependent cis to trans activation energies in alkanes of -300 to +380 cm-1.

Femtosecond laser studies of the cis-stilbene photoisomerization reactions

Sension, Roseanne J.,Repinec, Stephen T.,Szarka, Arpad Z.,Hochstrasser, Robin M.

, p. 6291 - 6315 (2007/10/02)

Femtosecond laser studies have been performed on the photoisomerization reactions of cis-stilbene to obtain the most detailed understanding to date of a polyatomic isomerization reaction in a condensed phase environment.These experiments demonstrate that vibrationally hot product molecules are formed within a few hundred femtoseconds of the escape of the molecule from the cis* region of the potential energy surface.Although the cis to trans reaction may proceed via a twisted intermediate structure, this intermediate is not intercepted on the ca. 150 fs time scale.The frictional effects on the cis to trans reaction coordinate are found to be important and account for the anisotropy of the trans product molecules.Specific experiments presented in detail are the absorption spectrum of electronically excited cis molecules (cis*); the anisotropy decays for cis* showing motion along the reaction coordinate; the detection of the trans-stilbene product using transient fluorescence and transient absorption, confirming that the reaction generates hot product states and that the Franck-Condon modes are largely spectators in the reaction; the anisotropy (alignment) of trans product molecules illustrating the effect of friction coupling overall motion to the reaction coordinate; and a theoretical treatment of three-pulse anisotropy experiments.

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