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Scale-up series · Part 3 of 3

From Pilot Data to a Mass and Energy Balance

The mass and energy balance is the first engineering document of a commercial design. It states how much of everything goes in and comes out, and how much heat must be added and removed. Equipment sizes, utility demand and operating cost are all calculated from it.

Post 1 showed why the commercial reactor needs a longer addition time than the lab. Post 2 covered the pilot campaign and its design yield of 87%. This post turns those results into a balance for a plant making 5,000 tonnes of product a year.

Step 1: set the basis

A balance needs a stated basis. For a batch process the natural basis is one batch.

Table 1. Basis for the commercial balance

ItemValueSource
Annual production5,000 t/y of productBusiness plan
Operating time8,000 h/yDesign basis
Batch cycle time8 hoursCharge 1 h, addition 3 h, hold 2 h, transfer 1 h, clean 1 h
Batches a year1,0008,000 h ÷ 8 h
Product per batch5,000 kg5,000 t ÷ 1,000 batches
Yield87%Mean of ten pilot runs

The three-hour addition comes from Post 1: the 10,000 L reactor needs at least 2.7 hours to remove the heat of reaction. A one-hour addition would have given a six-hour cycle and a smaller reactor, and the jacket could not have kept up.

Step 2: scale the pilot mass balance

The pilot runs used 100 kg batches. Each quantity is scaled by the ratio of product required, 5,000 kg ÷ 50 kg = 100.

Table 2. Mass balance: pilot batch, commercial batch and annual totals

StreamPilot batchCommercial batchAnnual
Raw material A30.0 kg3,000 kg3,000 t/y
Raw material B27.5 kg2,750 kg2,750 t/y
Solvent, fresh2.5 kg250 kg250 t/y
Solvent, recycled40.0 kg4,000 kg4,000 t/y
Total in100.0 kg10,000 kg10,000 t/y
Product50.0 kg5,000 kg5,000 t/y
Waste: by-products and unreacted material7.5 kg750 kg750 t/y
Waste: solvent losses2.5 kg250 kg250 t/y
Solvent recovered for recycle40.0 kg4,000 kg4,000 t/y
Total out100.0 kg10,000 kg10,000 t/y

The check on yield: raw materials A and B together are 5,750 kg, and 5,000 kg becomes product. That is 87%, which matches the pilot result. The totals in and out agree, so the balance closes.

Reactor10 m³ batchSeparation andsolvent recoveryRaw material A: 3,000 kgRaw material B: 2,750 kgFresh solvent: 250 kg10,000 kgProduct: 5,000 kgWaste: 1,000 kgRecovered solvent recycled: 4,000 kgIn: 6,000 kgOut: 6,000 kg
Figure 1. Block flow diagram for one commercial batch. Recycled solvent circulates inside the plant, so only the fresh solvent crosses the boundary.

Two results stand out. The reactor must hold a 10,000 kg batch, about 10 m³, so the vessel needs roughly 12.5 m³ of total volume at 80% fill. And the plant produces 1,000 t/y of waste, one tonne for every five tonnes of product, which sets the size of the waste handling system and the permit application.

Step 3: add the energy balance

Each heating or cooling step is calculated from the masses in Table 2 and the properties measured in the pilot plant.

Table 3. Energy balance for one batch

StepCalculationHeatUtility
Heat the batch from 20°C to 60°C10,000 kg × 2.0 kJ/kg·K × 40 K0.8 GJ375 kg of steam
Remove the heat of reaction10,000 kg × 150 kJ/kg1.5 GJCooling water on the jacket
Evaporate the solvent for recovery4,000 kg × 400 kJ/kg1.6 GJ750 kg of steam
Condense the recovered solventSame heat, removed1.6 GJCooling water on the condenser
Total per batch1,125 kg of steam, 3.1 GJ of cooling

Utilities are sized for the peak, which is higher than the average. The reaction heat of 1.5 GJ leaves over the three-hour addition, an average of 139 kW. The jacket can remove 154 kW, so it has about 10% in hand. That margin is thin, and it is the kind of result a design review should question.

Step 4: read the operating cost from the balance

With prices for each stream, the balance gives the variable cost of production. The prices below are illustrative.

$1.20$0.83Raw material A: $1.200 per kg (55.7%)Raw material B: $0.825 per kg (38.3%)Solvent make-up: $0.060 per kg (2.8%)Waste disposal: $0.060 per kg (2.8%)Steam: $0.009 per kg (0.4%)
Figure 2. Variable cost per kilogram of product, $2.15 in total. Raw materials are 94% of it.

Table 4. Variable cost from the mass and energy balance

Cost elementPer kg of productAnnualShare
Raw material A$1.200$6,000,00055.7%
Raw material B$0.825$4,125,00038.3%
Solvent make-up$0.060$300,0002.8%
Waste disposal$0.060$300,0002.8%
Steam$0.009$45,0070.4%
Total variable cost$2.154$10,770,007100%

Raw materials cost $10.1M a year. Yield therefore matters more than any utility saving. One more point of yield, from 87% to 88%, would cut raw material use by 1.1% and save about $115,000 a year. Halving the steam bill would save about $22,504.

What the balance hands to the next stage

Table 5. Where each result goes

Result from the balanceUsed for
Batch size and cycle timeReactor volume and the number of reactors
Raw material and product quantitiesStorage tanks, deliveries and shipping
Heat loads and their timingJacket area, condenser, boiler and cooling water system
Recycle and waste streamsSolvent recovery equipment, waste treatment and permits
Consumption per kilogram of productOperating cost estimate and the business case

These figures become the design basis and the heat and material balance for front-end engineering. The FEED series picks up from here, starting with the design basis.

To practise balance calculations, try the free Mass, Momentum & Energy Exam.

Takeaway. Scale the pilot balance to the commercial batch, check that it closes, then add the energy balance and prices. In the example, a 87% yield and a three-hour addition lead to a 10 m³ batch, 1,000 t/y of waste and a variable cost of $2.15 per kilogram.

The reaction, the vessels and the costs in this series are an illustrative example. The calculations are screening estimates and do not replace process safety testing or a design by a qualified engineer.

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