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‘day to day’ operation of process for monitoring operating efficiency Making calculations for design and development of a process i.e. quantities required, sizing equipment, number of items of equipment

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Module 9001 Mass Balance

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The accounting of all mass in a

chemical/pharmaceutical process is referred

to as a mass (or material) balance

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• ‘day to day’ operation of process for

monitoring operating efficiency

• Making calculations for design and

development of a process i.e quantities

required, sizing equipment, number of items

of equipment

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Simple example – batch mixing

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Total initial mass = total final mass = 300 kgInitial methanol mass = final methanol mass

80 + 70 = final methanol mass = 150 kg

Therefore final composition of batch is

(150/300) x 100 = 50 % by wt

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1000 kg of 8% by wt sodium hydroxide

(NaOH) solution is required 20% sodium hydroxide solution in water and pure water are available How much of each is

required?

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Integral balances are carried out on batch

processes where balances are carried out on

the initial and final states of the system.

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Simple batch reaction cycle

3 steps

Add reactants etc reaction Empty reactor

Next cycle

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Continuous processes

These processes are continuous in nature and operate in steady state and balances are

carried out over a fixed period of time

Materials enter and leave process

continuously

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Law of conservation of mass

When there is no net accumulation or

depletion of mass in a system (steady state) then:

Total mass entering system = total mass

leaving system

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General mass balance equation

Input + generation – output – consumption =

accumulation

Notes: 1 generation and consumption terms refer only to generation of

products and consumption of reactants as a result of chemical reaction

If there is no chemical reaction then these terms are zero.

2 Apply to a system

3 Apply to total mass and component mass

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• System – arbritary part or whole of a system

• Steady state/non-steady state

• Accumulation/depletion of mass in system

• Basis for calculation of mass balance (unit

of time, batch etc)

• Component or substance

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1000 kg of a 10 % by wt sodium chloride

solution is concentrated to 50 % in a batch evaporator Calculate the product mass and the mass of water evaporated from the

evaporator

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Mixing of streams

F1

F2

F4

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Calculate E and x

Fresh feed 1000kg, 15%

by wt sodium hydrogen carbonate

Recycle stream 300 kg, 10% satd soln

evaporator feed E, composition x%

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• Streams

• Operations/equipment sequence

• Standard symbols

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• Process flow diagram

• PID

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Typical simple flowsheet

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Exercise – batch distillation

1000 kg of a 20% by wt mixture of acetone in water is separated by multistage batch

distillation The top product (distillate)

contains 95% by wt acetone and the still

contains 2% acetone Calculate the amount

of distillate

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Use of molar quantities

It is often useful to calculate a mass balance using molar quantities of materials and to express composition as mole fractions or mole %

Distillation is an example, where equilibrium data is often expressed in mole fractions

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• To convert from moles of a substance to grams

multiply by the molecular weight

• To convert from grams to moles divide by the

molecular weight.

• Mole fraction is moles divided by total moles

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Exercise – batch distillation

1000 kmol of an equimolar mixture of

benzene and toluene is distilled in a

multistage batch distillation unit 90 % of

the benzene is in the top product (distillate) The top product has a benzene mole fraction

of 0.95 Calculate the quantities of top and bottom products and the composition of the

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Mass balance - crystalliser

A crystalliser contains 1000 kg of a saturated solution of potassium

chloride at 80 deg cent It is required to crystallise 100 kg KCl from this solution To what temperature must the solution be cooled?

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T deg cent Solubility

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At 80 deg cent satd soln contains (51.1/151.1)x100

% KCl i.e 33.8% by wt

So in 1000 kg there is 338 kg KCl & 662 kg water Crystallising 100 kg out of soln leaves a satd soln containing 238 kg KCl and 662kg water i.e

238/6.62 g KCl/100g water which is 36 g

KCl/100g So temperature required is approx 27 deg cent from table

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Mass balance filtration/centrifuge

feed suspension

wash water/solvent

solid

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Mass balance - drier

water/evaporated solvent

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Mass balance – extraction/phase

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Example (single stage extraction;

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F = 195 kg; xf = 0.11 kg API/kgwater

S = 596 kg chloroform

y = 1.72x, where y is kgAPI/kg chloroform in extract and x is kg

API/kg water in raffinate.

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Mass balance – absorption unit

feed gas stream

feed solvent exit gas stream

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Mass balances – multiple units

• Overall balance

• Unit balances

• Component balances

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Mass balance procedures

• Process description

• Flowsheet

• Label

• Assign algebraic symbols to unknowns

(compositions, concentrations, quantities)

• Select basis

• Write mass balance equations (overall, total, component, unit)

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A mass balance and tracking of usage of a solvent

used in an API production process is required for a Pollution Emission Register (PER)

Discuss and outline in general terms how you would

do this.

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• Refers to quantities of reactants and

products in a balanced chemical reaction

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Reactor mass balances

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Example – aspirin synthesis

reaction

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Limiting reactant/excess reactant

• In practice a reactant may be used in excess

of the stoichiometric quantity for various

reasons In this case the other reactant is

limiting i.e it will limit the yield of

product(s)

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A reactant is in excess if it is present in a

quantity greater than its stoichiometric

proportion

% excess = [(moles supplied – stoichiometric moles)/stoichiometric moles] x 100

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Example – aspirin synthesis

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• Fractional conversion = amount reactant

consumed/amount reactant supplied

• % conversion = fractional conversion x 100

Note: conversion may apply to single pass reactor

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Yield = (moles product/moles limiting

reactant supplied) x s.f x 100

Where s.f is the stoichiometric factor =

stoichiometric moles reactant required per mole product

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Example – aspirin synthesis

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Extent of reaction = (moles of component leaving reactor – moles of component entering

reactor)/stoichiometric coefficient of component

Note: the stoichiometric coefficient of a component

in a chemical reaction is the no of moles in the

balanced chemical equation ( -ve for reactants and

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i.e stoichiometric coefficients a = 1; b = 1

100 kmol fresh feed A; 90 % single pass

conversion in reactor; unreacted A is

separated and recycled and therefore overall process conversion is 100%

F

R

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Discussion - Synthesis of 3,3

dimethylindoline

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Discussion - Aspirin synthesis

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• Elementary Principles of Chemical

Processes, R M Felder and R W

Rousseau, 3rd edition, John Wiley, 2000

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