Structural Isomer Counter

Structural Isomer Counter MCP Connector for Claude

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Identify and count constitutional isomers for organic molecular formulas.

4 tools Official Updated Oct 1, 2026 Official Vinkius Partner

This MCP server provides specialized tools for organic chemistry analysis. It allows AI agents to determine the total number of unique constitutional isomers for a given molecular formula using get_isomer_count. Users can retrieve detailed structural information, including IUPAC names and condensed formulas, via list_isomer_details. The server also categorizes isomers into chain, position, or functional groups using get_isomer_classification, and ensures chemical validity with validate_formula_feasibility.

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4 tools expose this connector's capabilities to your AI agent.

get_isomer_classification

Segregates isomers into groups based on their specific type of structural isomerism

get_isomer_count

Determines the total number of unique constitutional isomers for a given molecular formula

list_isomer_details

Provides a detailed breakdown of every isomer, including its structure and systematic name

validate_formula_feasibility

Checks if a molecular formula can actually form stable organic structures based on standard valence rules

See how to talk to your AI agent using Structural Isomer Counter.

How many isomers are there for C3H8O?

There are 3 constitutional isomers for C3H8O: propan-1-ol, propan-2-ol, and methoxyethane.

List the details for C2H6O.

The isomers for C2H6O are ethanol (CH3CH2OH) and dimethyl ether (CH3OCH3).

Is C10H30 a valid molecular formula?

No, C10H30 is not a valid formula because the hydrogen count exceeds the maximum capacity for 10 carbon atoms.

The tool identifies constitutional isomers, specifically covering chain, position, and functional group isomers.

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