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7/27/2019 817 Lecture Notes 3 Fuels2
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ME 422
Introduction to Combustion
Fall 2013
Instructor: Dr. Elisa Toulson
Lecture 3-Fuels
Homework
Due September 12th:
Chapter 17 Questions 17.1, 17.2, 17.3, 17.8
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Natural Gas
Primarily methane with smaller quantities of otherlight (C2-C8) hydrocarbons,N2, CO2, He, hydrogen
sulfide, water, O2also present.
Natural gas usually forms underground and
rises towards the surface until it gets
trapped by some geological formation such
as layers of porous sedimentary rock with a
denser impermeable layer of rock on top.
Gas in these reservoirs is generally under
pressure so once a hole is made in the
impermeable rock the gas will escape on it
own.
Natural Gas UsesIn the U.S. natural gas is mostly used in
the transportation sector for fleets but
as of 2008 there were 9.6 million natural
gas vehicles worldwide, led by Pakistan
(2.0 million), Argentina (1.7 million),
Brazil (1.6 million), Iran (1.0 million), and
India (650,000)
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Biogas Biogas: a gas produced by the biological breakdown
of organic matter in the absence of oxygen
Biogas is produced by the anaerobic digestion or
fermentation of biodegradable materials such as
biomass, manure, sewage, municipal waste, green
waste, plant material, and crops.
Biogas comprises primarily methane (CH4) and
carbon dioxide (CO2) and may have small amounts
of hydrogen sulphide (H2S).
Compound Chem %
Methane CH4 5075
Carbon dioxide CO2 2550
Nitrogen N2 010Hydrogen H2 01
Hydrogen
sulfideH2S 03
Oxygen O2 00
Typical Composition of Biogas
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Synthetic Gas (Syngas)Gasification process for syngas production
C + H2O CO + H2
H298 = 175.3 kJ/molC + O2 CO2
H298 = -393.5 kJ/mol
CO2 + C 2CO
H298 = 172.5 kJ/mol
More than a million Wood Gas Vehicles were used
when fuel was rationed during World War 2.
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Fisher Tropsch Liquid Fuels
Interest in gas-to-liquid or Fischer-Tropsch diesel fuels hasincreased in recent years because of their potential to displace
imported petroleum.
Fisher-Tropsch process was invented in the 1920s in Germany
and during World War 2 production accounted for an
estimated 9% of German war production of fuels and 25% of
the automobile fuel.
The price of oil determines whether Fisher-Tropsch synthesis
fuels are viable as capitol costs are high.
Commercial Fisher-Tropsch synthesis plants have been in
operation in South Africa for more than 50 years where an
abundance of coal and government policy makes them viable.
Fisher Tropsch
Liquid Fuels
Synthetic Liquid Fuels can be generated from the syngas derived
from various feedstocks using the Fisher-Tropsch synthesis process.
The FischerTropsch process involves a series of chemical reactions
that produce a variety of hydrocarbons molecules .
The more useful reactions produce alkanes as follows:
(2n+1) H2+ n CO CnH(2n+2) + n H2O
Most of the alkanes produced tend to be straight-chain, suitable as
diesel fuel. In addition to alkane formation, competing reactions give
small amounts of alkenes, as well as alcohols and other oxygenated
hydrocarbons.
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Fisher-Tropsch Reactor
Hydrogen Hydrogen gas is highly flammable and will
burn in air at a very wide range ofconcentrations between 4% and 75% byvolume
When hydrogen combusts in air, theproducts are water and nitrogen, but thereis potential to form nitrogen oxides (NOx).
The main advantages of hydrogen are thatit burns easily, it can be used almostdirectly in systems that are well developedand reliable, and it can significantly reducefossil fuel consumption.
Hydrogen can be produced two ways: bythe decomposition of water throughelectrolysis or by the reformation of fossilfuels
The Space Shuttle Main
Engine burnt hydrogen with
oxygen, producing a nearly
invisible flame at full thrust.
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Considerations for the Choice of Fuels
For most combustion processes, air is used as theoxidizer because air is free and available almosteverywhere on earth.
Choice of fuel depends on purpose of thecombustion process and is subject to local safety
and emission regulations: Energy content per volume or per mass
Safety
Combustion and fuel properties
Cost
http://localhost/var/www/apps/conversion/tmp/scratch_4//upload.wikimedia.org/wikipedia/en/d/d9/Coal_and_biomass_co_converstion_to_transportation_fuels,_Michael_E_Reed,_DOE_NETL_Office_of_Fossil_Energy,_oct_17_2007.jpg7/27/2019 817 Lecture Notes 3 Fuels2
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Identification of Fuel by Molecular
Structure: IUPAC
The identification of a fuel can be best defined
by its molecular structure.
For organic chemistry, the convention adopted
by International Union of Pure and Applied
Chemistry (IUPAC) is well established and
should be used.
Naming Conventions for HydrocarbonFuels Commonly used for Combustion
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Naming Conventions
Prefixes for Hydrocarbon Fuels
Naming Conventions The word endingsane, -ene, -
yne indicate how the carbon
atoms are bound in the
molecule
Saturated is used to denote
hydrocarbon molecules in
which the maximum number of
hydrogen atoms is associatedwith carbon atoms (i.e. the
molecule has no double or
triple bonds)
Alkanes are saturated, Alkenes
and Alkynes are unsaturated
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Naming Conventions
n-octane C8H18iso-octane C8H18
2,2,4-trimethylpentane
Octane has
18 isomers
Alkanes with 3 or more carbons can have branches, and such alternative fuel
structures are called isomers. Straight chains are denoted as normal (n-)
Isomers are molecules with the same chemical formula and often the same kinds
of chemical bonds between atoms, but in which the atoms are arranged
differently Larger molecules tend to have more isomers.
Many isomers share similar if not identical properties in most chemical contexts.
Combustion characteristics of isomers, particularly their ignition properties, may
be quite different.
ExampleWhat is the structural formula for:
2,2,4-trimethyl pentane (iso-octane)
http://en.wikipedia.org/wiki/File:Isooctane-3D-vdW.pnghttp://en.wikipedia.org/wiki/File:Isooctane-3D-balls.pnghttp://en.wikipedia.org/wiki/File:2,2,4-Trimethylpentane.svg7/27/2019 817 Lecture Notes 3 Fuels2
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Question
What is the structural formula for
2-2 dimethylpropane ?
Answer
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Question
What is the structural formula for
2-4-5-trimethyl-3-ethyloctane?
Answer
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The basic molecular structure of Cyclanes is a
closed ring, with all carbon atoms singlybonded.
More complex cyclanes are formed by the
substitution of parraffinic groups for H atoms
Cyclanes
Methylcyclohexane: most common cycloalkane found in petroleum
Aromatics Aromatic or benzene family is based on a ring of 6 carbons but with
only one hydrogen atom associated with each carbon atom.
The resulting 6 free valence electrons from resonance hybrid bonds
among the six carbon atoms in the ring so that all of the bonds are
equivalent, with the bonding electrons delocalized over several atoms
The term 'aromatic' was assigned before the physical mechanism
determining aromaticity was discovered, and was derived from
the fact that many of the compounds have a sweet scent.
ethylbenzene
or
Toluene or
methylbenzene
Asprin
Napthalene
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Alcohols (ROH) Common alcohols are formed by the substitution of a
hydroxyl group (OH) for an H atom in an alkane molecule. Alcohols are generically designated as ROH, where R is the
hydrocarbon radical
Aldehyde
Aldehydes can be emitted from diesel engines and
those fueled with alcohols.
Aldehydes contribute to photochemical smog
Formaldehyde, Volatile Organic Compound (VOC)
SMOG
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Ketones
Ketones are used as solvents and are formed
as intermediate species of Hydrocarbon
combustion
Acetone is a common Ketone
Ether (R-O-R)
The general structure of an ether is
or Dimethyl ether
Diethyl ether
or
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Esters
Esters are chemical compounds consisting of a carbonyl adjacentto an ether linkage which are derived by reacting an oxoacid with
a hydroxyl compound such as an alcohol or phenol
Ester names are derived from the parent alcohol and the parent
acid
Most naturally occurring fats and oils are the fatty acid esters of
glycerol
Esters- Important constituents ofbiodiesel
Methyl linoleate a
methyl ester produced
from soybean or canola
oil and methanol
Ethyl stearate an ethyl ester
produced from soybean or
canola oil and ethanol
The five primary methyl esters found in biodiesel
fuels produced from soy and rapeseed
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Relative amounts of various chemical classes in dieselfuel and possible compounds to represent thesechemical classes in a diesel surrogate fuel
General Distribution of Hydrocarbonsin Gasoline
Gasoline can consist of more that 500 different types ofhydrocarbons between 5 and 12 carbons.
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Properties of Fuels
Ignition Characteristics
Volatility
Energy Density
Flash Point
Pour Point
Cloud Point
Spark Ignition Engine Ignition Ignition Quality refers to the prevention of Knock
Knock is the spontaneous ignition (auto-ignition or detonation)of the endgas (unburned
mixture) ahead of the flame.
Detonation is characterized by an instantaneous, explosive ignition of at least one pocket
of fuel/air mixture outside of the flame front. A local shockwave is created and the cylinder
pressure may rise sharply beyond its design limits and cause engine damage.
Pre-ignition is when the mixture in the cylinder ignites before the spark plug fires. Pre-
ignition is initiated by an ignition source other than the spark
Engine damage due to knock
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Normal
Combustion
Pre-Ignition
Knock