Isopropyl propionate (C6H12O2)

Isopropyl Propionate presents a C6 framework, an ester (formula C6H12O2, CAS 637-78-5). ChemicalTool Reaction can propose ranked disconnections for Isopropyl Propionate from the SMILES CCC(=O)OC(C)C.

Target: Isopropyl propionate
CAS: 637-78-5
Formula: C6H12O2
Approx. MW: 116.16
SMILES: CCC(=O)OC(C)C
PubChem CID: 12508
Approx. carbons: C6

Isopropyl propionate structure

Properties

Molecular weight: 116.16

View on PubChem

Isopropyl propionate 1H / 13C NMR spectrum →

FAQ

What is the chemical formula of Isopropyl propionate?

Isopropyl propionate has molecular formula C6H12O2. Molecular weight about 116.16 g·mol⁻¹.

What is the CAS number of Isopropyl propionate?

The CAS Registry Number for Isopropyl propionate is 637-78-5.

Run AI retrosynthesis for Isopropyl propionate Target catalog AI tools overview

Start from this SMILES and explore AI retrosynthesis routes for C6H12O2.

Related targets

Similar compounds

Isobutyl Acetate 2-(Dimethylamino)ethyl acetate 2-(Trimethylsilyl)methyl acetate 2-Methoxyethyl Acrylate 4-Chlorobutyl acetate Allyl Ethyl Carbonate

Browse the full target catalog

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.