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Mol2Mat.

Chemistry & materials

From molecular structure to material properties, Mol2Mat provides tools for searching, comparing and analysing experimental data.

Free to use. No account required.

Compounds

Look up a name, formula or structure. Compound records bring together molecular structures, properties and references, with further data from PubChem and related chemical forms from ChEBI.

Reactions

Find the starting materials, products, reagents and conditions for a transformation, then follow its mechanism or references. Records include teaching examples, experimental data from ORD and biochemical reactions from Rhea.

Synthesis routes

See how individual reactions connect. Maps show the wider network; pathways lay out a sequence of recorded steps, each with its conditions and references.

Materials

Browse crystal, optical, thermal and mechanical data, including polymers and semiconductors. Compare records by phase, grade and measurement conditions, with measured and calculated values identified separately.

Working with data

Fit a curve, inspect the residuals, estimate uncertainty or examine a spectrum. Tools also cover mechanics, diffusion, phase equilibrium and optical response. Export results with the inputs, units and model assumptions used.

References

Data sources include PubChem, ChEBI, ORD, Rhea, COD, NIST, refractiveindex.info and AFLOW. Records retain their source identifiers and reported conditions, so the original data can be checked.

Mol2Mat