CHEMINFORMATICS SUITE

Advanced Chemical Analytics

Powerful tools for molecular analysis, visualization, and data processing

Cheminformatics Tools

Molar Mass Calculator

Calculate molecular weights

Calculate the molar mass of any chemical compound from its molecular formula. Supports standard chemical notation and provides detailed element breakdown.

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NMR Predictor

Predict NMR spectra

Predict 1H and 13C NMR spectra from molecular structures. Get chemical shifts, coupling patterns, and peak integrations for organic compounds.

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Pressure Unit Converter

Convert pressure units

Convert between different pressure units including Pa, bar, atm, psi, torr, and more. Essential for engineering and scientific calculations.

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SMILES to Structure Converter

Visualize molecular structures

Convert SMILES notation to 2D molecular structures. Visualize chemical compounds with proper bond angles and atom positioning.

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Spectroscopy File Converter

Convert spectroscopy data

Convert between different spectroscopy file formats. Support for JCAMP-DX, CSV, and other common formats used in analytical chemistry.

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Stoichiometry Calculator

Balance chemical equations

Balance chemical equations and perform stoichiometric calculations. Calculate limiting reagents, theoretical yields, and reaction quantities.

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Vapor Pressure Calculator

Calculate vapor pressures

Calculate vapor pressure using the Antoine equation. Essential for chemical engineering, distillation design, and phase equilibrium calculations.

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Featured Molecules

Discover interesting chemical compounds making headlines

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Aspirin

50-78-2

C9H8O4

A molecule with interesting chemical properties and applications.

Caffeine

58-08-2

C8H10N4O2

A molecule with interesting chemical properties and applications.

Ethanol

64-17-5

C2H6O

A molecule with interesting chemical properties and applications.

Vanillin

121-33-5

C8H8O3

A molecule with interesting chemical properties and applications.
48591
Compounds
8
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