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Deep Data
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Chemical Compounds
Formula

Mol-Instincts Web-Information Project

Instant Formula For Over 100 Million Compounds

The chemical formula of chemical compounds is one of the basic information for research and development, which are frequently available only at a specific chemical-related website when the compound is not popular. For our Mol-Instincts customers, we have developed an automatic process to generate the formula of chemical compounds available on the web. The formula can instantly be found by Google search as long as Google indexes them.

The total number of chemical compounds processed so far is over 100 millions. We will continuously update the additional formula information of rare chemical compounds.

Search Chemical Formula

Enter compound to search for chemical formula:

Input a chemical compound consisting of C, H, N, O, S, F, Cl, Br, I, Si, P, and/or As atom(s)

Input example for Ethanol:

  • Name: ethanol
  • CAS #: 64-17-5
  • Formula: C2H5OH
  • Smiles: CCO
  • InChI: InChI=1S/C2H6O/c1-2-3/h3H,2H2,1H3
  • InChIKey: LFQSCWFLJHTTHZ-UHFFFAOYSA-N

What’s Available

In addition to the formula information, basic molecular information such as molecular weight, chemical identifier, e.g., IUPAC name, SMILES String, InChI, etc., as well as a 2-dimensional and 3-dimensional images are provided.

Click the following link to visit an example page:

Example Page

Cholesterol Formula - C27H46O | Mol-Instincts

This information stems from Chemical Compounds DEEP DATA SOURCE

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Deep Data Application Examples

Our Deep Data encompasses property data, spectral data, quantum chemical data, and molecular descriptor data for a wide range of chemical compounds. It features more than 2,100 high-quality datasets per single chemical compound, totaling over 8 billion datasets for 4.1+ million chemical compounds. Below are some application examples that may interest you: