Butyrate (C4H7O2-)

butyrate presents a C4 framework, a carboxylic acid (formula C4H7O2-, CAS 461-55-2). ChemicalTool Reaction can propose ranked disconnections for butyrate from the SMILES CCCC(=O)[O-].

Target: Butyrate
CAS: 461-55-2
Formula: C4H7O2-
Approx. MW: 87.10
SMILES: CCCC(=O)[O-]
PubChem CID: 104775
Approx. carbons: C4

Butyrate structure

Properties

Molecular weight: 87.10

View on PubChem

Butyrate 1H / 13C NMR spectrum →

FAQ

What is the chemical formula of Butyrate?

Butyrate has molecular formula C4H7O2-. Molecular weight about 87.10 g·mol⁻¹.

What is the CAS number of Butyrate?

The CAS Registry Number for Butyrate is 461-55-2.

Run AI retrosynthesis for Butyrate Target catalog AI tools overview

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Related targets

Similar compounds

(+-)-Aspartic acid 2-(Bromomethyl)acrylic acid 2-(Trifluoromethyl)acrylic acid 2-amino-3-hydroxybutanoic acid 2-Aminobutyric acid 2-Aminoisobutyric acid

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References & tools

ChemicalTool Reaction — AI retrosynthesis with optional library evidence.
PubChem — compound identifiers and structure depictions (NIH/NCBI).
Related: AiZynthFinder / synthesis planning literature for computer-aided retrosynthesis.