Effects of Poly(glycidyl ether) Structure and Ether Oxygen Placement on CO2 Solubility

2021 ◽  
Author(s):  
Caitlin L. Bentley ◽  
Tangqiumei Song ◽  
Benjamin J. Pedretti ◽  
Michael J. Lubben ◽  
Nathaniel A. Lynd ◽  
...  
Keyword(s):  
Glycidyl Ether ◽  
Co2 Solubility ◽  
Ether Oxygen

Modelling the Effects of Acid Deposition: Estimation of Long-Term Water Quality Responses in Forested Catchments in Finland

1988 ◽  
Vol 19 (2) ◽  
pp. 99-120 ◽  
Author(s):  
A. Lepistö ◽  
P. G. Whitehead ◽  
C. Neal ◽  
B. J. Cosby
Keyword(s):  
Water Quality ◽  
Surface Water ◽  
Base Cations ◽  
Surface Water Quality ◽  
Mineral Weathering ◽  
Co2 Solubility ◽  
Forested Catchments ◽  
Deposition Rates ◽  
Magic Model

A modelling study has been undertaken to investigate long-term changes in surface water quality in two contrasting forested catchments; Yli-Knuutila, with high concentrations of base cations and sulphate, in southern Finland; and organically rich, acid Liuhapuro in eastern Finland. The MAGIC model is based on the assumption that certain chemical processes (anion retention, cation exchange, primary mineral weathering, aluminium dissolution and CO2 solubility) in catchment soils are likely keys to the responses of surface water quality to acidic deposition. The model was applied for the first time to an organically rich catchment with high quantities of humic substances. The historical reconstruction of water quality at Yli-Knuutila indicates that the catchment surface waters have lost about 90 μeq l−1 of alkalinity in 140 years, which is about 60% of their preacidification alkalinity. The model reproduces the declining pH levels of recent decades as indicated by paleoecological analysis. Stream acidity trends are investigated assuming two scenarios for future deposition. Assuming deposition rates are maintained in the future at 1984 levels, the model indicates that stream pH is likely to continue to decline below presently measured levels. A 50% reduction in deposition rates would likely result in an increase in pH and alkalinity of the stream, although not to estimated preacidification levels. Because of the high load of organic acids to the Liuhapuro stream it has been acid before atmospheric pollution; a decline of 0.2 pH-units was estimated with increasing leaching of base cations from the soil despite the partial pH buffering of the system by organic compounds.

Participation of 19-ester groups in the cleavage of 2α,3α- and 5α,6α-steroid epoxides. A case of competition between participation and external nucleophile attack

1979 ◽  
Vol 44 (5) ◽  
pp. 1496-1509 ◽  
Author(s):  
Pavel Kočovský ◽  
Václav Černý
Keyword(s):  
Perchloric Acid ◽  
Hydrobromic Acid ◽  
Ester Group ◽  
Carbonyl Oxygen ◽  
Cyclic Carbonate ◽  
Cyclic Ether ◽  
Normal Reaction ◽  
Neighboring Group ◽  
Ether Oxygen ◽  
The Difference

Acid cleavage of the acetoxy epoxide IIIa with aqueous perchloric acid or hydrobromic acid gave two types of products, i.e. the diol Va or the bromohydrin VIa, and the cyclic ether VIII. The latter compound arises by participation of ether oxygen of the ester group. On reaction with perchloric acid the epoxide IVa gave the diol XIIIa as a product of a normal reaction and the isomeric diol Xa as a product arising by intramolecular participation of the carbonyl oxygen of the 19-acetoxy group. Participation of the 19-ester group is confirmed by the formation of the cyclic carbonate XI when the 19-carbonate IVb is treated analogously. On reaction with hydrobromic acid, the epoxide IVa gave solely the bromohydrin XIVa as a product of the normal reaction course. Discussed is the similarity of these reactions with electrophilic additions to the related 19-acetoxy olefins I and II, the mechanism, the difference in behavior of both epoxides III and IV, the dependence of the product ratio on the nucleophility of the attacking species, and the competition between participation of an ambident neighboring group and an external nucleophile attack.

scholarly journals An improved model for CO2 solubility in aqueous Na+–Cl−–SO42− systems up to 473.15 K and 40 MPa

2021 ◽  
pp. 120443
Author(s):  
Pedro F. dos Santos ◽  
Laurent Andre ◽  
Marion Ducousso ◽  
Arnault Lassin ◽  
François Contamine ◽  
...  
Keyword(s):  
Co2 Solubility ◽  
Improved Model

Crystal structure of tamsulosin hydrochloride, C20H29N2O5SCl

2021 ◽  
pp. 1-7
Author(s):  
Nilan V. Patel ◽  
Joseph T. Golab ◽  
James A. Kaduk ◽  
Amy M. Gindhart ◽  
Thomas N. Blanton
Keyword(s):  
Crystal Structure ◽  
Hydrogen Bond ◽  
Hydrogen Atom ◽  
Powder Diffraction ◽  
Density Functional ◽  
Carbon Chain ◽  
Strong Hydrogen Bond ◽  
Powder Diffraction File ◽  
Ether Oxygen ◽  
Sulfonamide Group

The crystal structure of tamsulosin hydrochloride has been solved and refined using synchrotron X-ray powder diffraction data and optimized using density functional techniques. Tamsulosin hydrochloride crystallizes in space group P21 (#4) with a = 7.62988(2), b = 9.27652(2), c = 31.84996(12) Å, β = 93.2221(2)°, V = 2250.734(7) Å3, and Z = 4. In the crystal structure, two arene rings are connected by a carbon chain oriented roughly parallel to the c-axis. The crystal structure is characterized by two slabs of tamsulosin hydrochloride molecules perpendicular to the c-axis. As expected, each of the hydrogens on the protonated nitrogen atoms makes a strong hydrogen bond to one of the chloride anions. The result is to link the cations and anions into columns along the b-axis. One hydrogen atom of each sulfonamide group also makes a hydrogen bond to a chloride anion. The other hydrogen atom of each sulfonamide group forms bifurcated hydrogen bonds to two ether oxygen atoms. The powder pattern is included in the Powder Diffraction File™ as entry 00-065-1415.

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