How to simulate integrated styrene chain: benzene to styrene monomer
The full two-step styrene chain connected as one flowsheet rather than two standalone process snippets: benzene alkylated with ethylene to ethylbenzene, purified in a recovery column, then fed directly to the dehydrogenation reactor that makes styrene monomer. The unreacted ethylbenzene the dehydrogenation column recovers is reported as its own product stream rather than recycled back onto the alkylation feed (an honest simplification — closing that loop needs a torn-recycle edge back into ALKCOL, which the plant does but this flowsheet does not).
- 1Open the ready-made model
Open the "Integrated styrene chain: benzene to styrene monomer" model in the MaximaLabs workspace — no install, no license. It loads live on the canvas, ready to edit and run.
- 2Confirm the thermodynamics
This process is modeled with the PENG-ROBINSON property package over ethylene, benzene, ethylbenzene, styrene, h2 — already selected, so the phase equilibrium and enthalpy are physically consistent from the first run.
- 3Review the flowsheet
The flowsheet chains 2× Dehydro, 2× Reheat, 2× Stycol, SEP. Every block is a real, solvable unit op you can reconfigure on the canvas.
- 4Run the simulation
Click Run. The deterministic solver converges the material and energy balances (recycles included) and fills the live stream table — the AI never invents a number.
- 5Read the results and iterate
Inspect the converged streams, tweak a spec, and re-run — or ask the AI copilot to explain a result or diagnose a failed solve in plain English.
- Thermodynamics
- PENG-ROBINSON
- Components
- ethylene, benzene, ethylbenzene, styrene, h2
- Unit operations
- 2× Dehydro2× Reheat2× StycolSEP
Opens live on the canvas — free, no install.
Explore the model & flowsheetFrequently asked questions
- What does the Integrated styrene chain: benzene to styrene monomer model simulate?
- The full two-step styrene chain connected as one flowsheet rather than two standalone process snippets: benzene alkylated with ethylene to ethylbenzene, purified in a recovery column, then fed directly to the dehydrogenation reactor that makes styrene monomer. The unreacted ethylbenzene the dehydrogenation column recovers is reported as its own product stream rather than recycled back onto the alkylation feed (an honest simplification — closing that loop needs a torn-recycle edge back into ALKCOL, which the plant does but this flowsheet does not).
- Which thermodynamic method does it use?
- The PENG-ROBINSON property package, over ethylene, benzene, ethylbenzene, styrene, h2 — already selected. You can switch the method on the canvas before running.
- Which unit operations are in the flowsheet?
- It chains 2× Dehydro, 2× Reheat, 2× Stycol, SEP. Every block is a real, solvable unit operation you can reconfigure, add to, or remove.
- Do I need to install software or buy a license?
- No. Integrated styrene chain: benzene to styrene monomer runs entirely in your browser on MaximaLabs — free, no install, no license. Open the model to load it live and run the deterministic solver.
More guides like this
Styrene monomer via ethylbenzene dehydrogenation
Ethylbenzene dehydrogenates over an equilibrium/conversion reactor to styrene monomer plus hydrogen — the endothermic reaction that supplies the world's polystyrene/SBR-rubber feedstock. A downstream column recovers unreacted ethylbenzene overhead for recycle while polymer-grade styrene leaves the bottoms. Vasudevan design, Ind. Eng. Chem. Res. 2009, 48, 10941 (Figure 15.1).
LOHC hydrogen release (methylcyclohexane dehydrogenation)
A liquid organic hydrogen carrier (LOHC) power train: methylcyclohexane (MCH) is preheated and catalytically dehydrogenated (MCH → toluene + 3H2, endothermic, equilibrium-limited to ~90% single-pass conversion) to release hydrogen for downstream power generation. A flash drum separates the H₂-rich gas from the liquid; a distillation column then recovers the unreacted MCH overhead and recycles it to the reactor feed, closing a real tight liquid recycle loop, while spent toluene leaves the bottoms (to be re-hydrogenated back to MCH off-site, closing the supply-chain loop — out of scope for this dehydrogenation-side flowsheet). Screening-fidelity note: MCH and toluene are genuinely close-boiling (relative volatility ~1.4 under this thermo package at column conditions), so the recycle carries real toluene along with the recovered MCH rather than a sharp cut — a production column would use more stages to purify it further; this shows the recycle topology and its convergence, not an optimized column design.
Propane dehydrogenation cold box
Propane dehydrogenation (PDH) to propylene over a Pt/Cr catalyst, followed by a cold-box separation recovering liquid propylene from the H₂-rich reactor off-gas, after US Patent 6,333,445 (Chart Inc., 2002). The refrigeration loop itself is not modeled — the cold box is represented here as a net cooling duty to condense the propylene, a bounded simplification. Unreacted propane recycle is not modeled either (reported as its own product stream).
Methyl ethyl ketone from 2-butanol dehydrogenation
Catalytic dehydrogenation of 2-butanol to methyl ethyl ketone (MEK) over an In/MgO catalyst, per DE2831465A1 (1978), followed by a flash to remove the H₂ co-product and a distillation splitting MEK from unreacted 2-butanol.
Acetone from isopropanol dehydrogenation
Endothermic gas-phase dehydrogenation of isopropanol (IPA) to acetone, after Luyben (Ind. Eng. Chem. Res. 2011, 50, 1206). The H₂-rich reactor off-gas is scrubbed with water to recover the acetone before venting, then a column splits acetone from the water/unreacted-IPA absorbent.
2,6-Xylenol from phenol methylation
Liquid-phase methylation of phenol with methanol at 250°C/150 bar over a selective ortho-methylation catalyst, per US Patent 3,707,569. At 50% single-pass phenol conversion the reported selectivity is 70% to o-cresol and 25% to 2,6-xylenol (the further-methylated product) — modeled here as two sequential fixed-conversion reactors (phenol → o-cresol, then o-cresol → 2,6-xylenol) approximating that split, followed by a distillation separating the light methanol/water from the phenolics. The five-component side-draw column sits in the same successive-substitution residual plateau documented for the light-ends-train and DME-synthesis examples — it returns a physically reasonable partial profile rather than a clean converged status.