Saturated Vapor Pressure Measurements for Tetraethyl,\nTetrapropyl, and Tetrabutyl Orthosilicates up to 473 K

The\nsaturated vapor pressures of tetraethyl orthosilicate (TEOS,\n(CH<sub>3</sub>CH<sub>2</sub>O)<sub>4</sub>Si), tetrapropyl orthosilicate\n(TPOS, (CH<sub>3</sub>CH<sub>2</sub>CH<sub>2</sub>O)<sub>4</sub>Si),\nand tetrabutyl orthosilicate (TBOS, (CH<sub>3</sub>CH<sub>2</sub>CH<sub>2</sub>CH<sub>2</sub>O)<sub>4</sub>Si) were measured at temperatures\nup to 473 K using an apparatus based on the general static method.\nThe standard uncertainties (<i>u</i><sub><i>s</i></sub>) were <i>u</i><sub><i>s</i></sub> (<i>T</i>) = 0.029 K and <i>u</i><sub><i>s</i></sub> (<i>p</i>) = 0.015 kPa, and the maximum combined\nexpanded uncertainties <i>U</i> (0.95 level of confidence)\nwere <i>U</i>(<i>T</i>) = (0.52, 8.60, and 1.64\nK) and <i>U</i>(<i>p</i><sup>sat</sup>) = (2.81,\n3.09, and 0.82 kPa) for TEOS, TPOS, and TBOS, respectively. Furthermore,\nthe saturated vapor pressure was correlated using the Antoine equation\nto determine its parameters. The measured saturated vapor pressures\nwere correlated with previously reported pressure–volume-temperature\ndata using the PC-SAFT equation of state (EoS), followed by optimizing\nthe pure component parameters of the PC-SAFT EoS. A relationship between\nthe molecular structure and component parameters was identified, and\nthe occupied volumes were determined according to the Sanchez–Lacombe\nand PC-SAFT EoS, revealing significant differences. Our findings highlight\nthe potential of using the molecular structure to predict pure component\nparameters. In addition to providing accurate vapor pressure data\nfor these orthosilicates, this study offers insights into correlation\nmethods, emphasizing the importance of parameter determination in\nequation of state modeling.

Publication Details

Journal
Figshare
Published
2024-09-16
DOI
https://doi.org/10.1021/acs.jced.4c00325.s001
Primary Topic
Phase Equilibria and Thermodynamics
Type
article
Field-Weighted Citation Impact
0.00
Controls
|||
ALL TIME
JAN
FEB
MAR
APR
MAY
JUN
JUL
AUG
SEP
OCT
article

Saturated Vapor Pressure Measurements for Tetraethyl,\nTetrapropyl, and Tetrabutyl Orthosilicates up to 473 K

Figshare
Phase Equilibria and Thermodynamics
article

Saturated Vapor Pressure Measurements for Tetraethyl,\nTetrapropyl, and Tetrabutyl Orthosilicates up to 473 K

article en

Abstract

The\nsaturated vapor pressures of tetraethyl orthosilicate (TEOS,\n(CH<sub>3</sub>CH<sub>2</sub>O)<sub>4</sub>Si), tetrapropyl orthosilicate\n(TPOS, (CH<sub>3</sub>CH<sub>2</sub>CH<sub>2</sub>O)<sub>4</sub>Si),\nand tetrabutyl orthosilicate (TBOS, (CH<sub>3</sub>CH<sub>2</sub>CH<sub>2</sub>CH<sub>2</sub>O)<sub>4</sub>Si) were measured at temperatures\nup to 473 K using an apparatus based on the general static method.\nThe standard uncertainties (<i>u</i><sub><i>s</i></sub>) were <i>u</i><sub><i>s</i></sub> (<i>T</i>) = 0.029 K and <i>u</i><sub><i>s</i></sub> (<i>p</i>) = 0.015 kPa, and the maximum combined\nexpanded uncertainties <i>U</i> (0.95 level of confidence)\nwere <i>U</i>(<i>T</i>) = (0.52, 8.60, and 1.64\nK) and <i>U</i>(<i>p</i><sup>sat</sup>) = (2.81,\n3.09, and 0.82 kPa) for TEOS, TPOS, and TBOS, respectively. Furthermore,\nthe saturated vapor pressure was correlated using the Antoine equation\nto determine its parameters. The measured saturated vapor pressures\nwere correlated with previously reported pressure–volume-temperature\ndata using the PC-SAFT equation of state (EoS), followed by optimizing\nthe pure component parameters of the PC-SAFT EoS. A relationship between\nthe molecular structure and component parameters was identified, and\nthe occupied volumes were determined according to the Sanchez–Lacombe\nand PC-SAFT EoS, revealing significant differences. Our findings highlight\nthe potential of using the molecular structure to predict pure component\nparameters. In addition to providing accurate vapor pressure data\nfor these orthosilicates, this study offers insights into correlation\nmethods, emphasizing the importance of parameter determination in\nequation of state modeling.

Figshare
Openalex Percentile: Top 73%
Phase Equilibria and Thermodynamics
AI Navigator

Ask Laika to Summarize, Analyze, and Connect papers live on the map.

Summarize Papers & Methodologies

Extract key findings, datasets, and comparative methods across publications.

Benchmark Rankings & Visual Analytics

Rank top research institutions, authors, funders, topics, and journals by Field-Weighted Citation Impact (FWCI) and paper volume with instant charts.

Connect Distant Disciplines

Bridge topological clusters on the map to find hidden collaborative intersections.