Industrial Chemistry Consulting

Chemistry Safety & Modelling Toolkit

A professional suite for chemical hazard lookup, thermochemical screening, physical property extraction, lubricant formulation, and safety-envelope evaluation.

1

PubChem Safety + GHS H-Codes

Retrieve safety data and extract GHS hazard codes. Export results to CSV.

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2

Heat Estimator

SMILES-based heat of polymerisation and latent heat estimator using RDKit.

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3

Hazard + Physical Properties

Lookup chemical properties and export clean summaries to Excel or PDF.

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4

Alternative Heat Estimator

Your supplied RDKit estimator interface, kept as a separate tool.

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5

Original-Style Hazard Lookup

The familiar hazard lookup interface, now made multi-user safe.

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6

Safety Envelope Builder

Build scenarios, add components, and screen thermal and pressure risk.

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7

Free-Radical & Emulsion Property Predictor

Run bulk, solution and emulsion formulation screening, property prediction, physical-polymer equations and UPR–styrene cure/exotherm modelling.

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8

Condensation & Step-Growth Property Predictor

Run functional-group kinetics, reactor comparison, molecular-weight, thermal/vacuum and structure–property calculations.

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9

Lubricant Formulation Studio

Design compressor, hydraulic, gear and metalworking lubricant blends with viscosity, cost and performance screening.

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10

PubChem Quick Launcher

Open the separate call_pubchem.py Flask tool from /home/ddewetroos.

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11

Runaway Reaction Predictor

Open runaway_flask_app_vs2.py using workbooks from /home/ddewetroos/SPREADSHEETS.

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