3-Isochromanone (C9H8O2)

3-Isochromanone presents a C9 framework (formula C9H8O2, CAS 4385-35-7). ChemicalTool Reaction can propose ranked disconnections for 3-Isochromanone from the SMILES O=C1Cc2ccccc2CO1.

Target: 3-Isochromanone
CAS: 4385-35-7
Formula: C9H8O2
Approx. MW: 148.16
SMILES: O=C1Cc2ccccc2CO1
PubChem CID: 78092
Approx. carbons: C9

3-Isochromanone structure

Properties

Molecular weight: 148.16

View on PubChem

3-Isochromanone 1H / 13C NMR spectrum →

FAQ

What is the chemical formula of 3-Isochromanone?

3-Isochromanone has molecular formula C9H8O2. Molecular weight about 148.16 g·mol⁻¹.

What is the CAS number of 3-Isochromanone?

The CAS Registry Number for 3-Isochromanone is 4385-35-7.

Run AI retrosynthesis for 3-Isochromanone Target catalog AI tools overview

One click loads 3-Isochromanone into ChemicalTool Reaction for route exploration.

Related targets

Similar compounds

4-Chromanone dihydrocoumarin Vinyl benzoate

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.