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Title: A Rapid Compression Machine Study of 2-Phenylethanol Autoignition at Low-To-Intermediate Temperatures

Journal Article · · Energies
DOI: https://doi.org/10.3390/en14227708 · OSTI ID:1831312

To meet the increasing anti-knocking quality demand of boosted spark-ignition engines, fuel additives are considered an effective approach to tailor fuel properties for satisfying the performance requirements. Thus, screening/developing bio-derived fuel additives that are best-suited for advanced spark-ignition engines has become a significant task. 2-Phenylethanol (2-PE) is an attractive candidate that features high research octane number, high octane sensitivity, low vapor pressure, and high energy density. Recognizing that the low temperature autoignition chemistry of 2-PE is not well understood and the need for fundamental experimental data at engine-relevant conditions, rapid compression machine (RCM) experiments are therefore conducted herein to measure ignition delay times (IDTs) of 2-PE in air over a wide range of conditions to fill this fundamental void. These newly acquired IDT data at low-to-intermediated temperatures, equivalence ratios of 0.35–1.5, and compressed pressures of 10–40 bar are then used to validate the 2-PE model developed by Shankar et al. (2017). It is found that this literature model greatly overpredicts the current RCM data. The comparison of experimental and simulated results also provides insights into 2-PE autoignition behaviors at varying conditions. Further chemical kinetic analyses demonstrate that the absence of the O2-addition pathway of β-R. radical in the 2-PE model of Shankar et al. (2017) could account for the model discrepancies observed at low-to-intermediated temperatures.

Sponsoring Organization:
USDOE
Grant/Contract Number:
Standard Research Subcontract No. B630575
OSTI ID:
1831312
Journal Information:
Energies, Journal Name: Energies Vol. 14 Journal Issue: 22; ISSN 1996-1073
Publisher:
MDPI AGCopyright Statement
Country of Publication:
Switzerland
Language:
English

References (18)

A Rapid Compression Machine for Chemical Kinetics Studies at Elevated Pressures and Temperatures journal March 2007
A detailed combined experimental and theoretical study on dimethyl ether/propane blended oxidation journal June 2016
Antiknock quality and ignition kinetics of 2-phenylethanol, a novel lignocellulosic octane booster journal January 2017
Ignition delay study of moist hydrogen/oxidizer mixtures using a rapid compression machine journal April 2012
Thermal decomposition of 2-phenylethanol: A computational study on mechanism journal January 2013
Knock Resistance and Fine Particle Emissions for Several Biomass-Derived Oxygenates in a Direct-Injection Spark-Ignition Engine journal April 2016
Experimental study on combustion characteristics and emission performance of 2-phenylethanol addition in a downsized gasoline engine journal November 2018
The Effect of the Position of Oxygen Group to the Aromatic Ring to Emission Performance in a Heavy-Duty Diesel Engine journal January 2012
Using rapid compression machines for chemical kinetics studies journal October 2014
Pressure and temperature effects on fuels with varying octane sensitivity at high load in SI engines journal March 2017
Rapid Compression Machines: Heat Transfer and Suppression of Corner Vortex journal August 1998
Investigation of Oxidation Reaction Products of 2-Phenylethanol Using Synchrotron Photoionization journal July 2018
Properties of Oxygenates Found in Upgraded Biomass Pyrolysis Oil as Components of Spark and Compression Ignition Engine Fuels journal March 2015
Reaction Mechanism Generator: Automatic construction of chemical kinetic mechanisms journal June 2016
Non-fermentative pathways for synthesis of branched-chain higher alcohols as biofuels journal January 2008
Fuel molecular structure effect on autoignition of highly branched iso-alkanes at low-to-intermediate temperatures: Iso-octane versus iso-dodecane journal April 2020
Knocking combustion in spark-ignition engines journal July 2017
A high-pressure rapid compression machine study of n-propylbenzene ignition journal January 2014