4-Oxo-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinoline-5-carbaldehyde

• Catalog Number: ACMA00001053
• Category: Amines
• Molecular Weight: 199.21
• Molecular Formula: C₁₃H₁₂ClN
• Hazard Statements: H302-H319
• RIDADR: UN 2811 6.1 / PGIII
• Symbol: GHS07

Custom Q&A

What is the molecular formula of the compound with PubChem CID 2736146?

The molecular formula is C12H9NO2.

What is the molecular weight of the compound?

The molecular weight is 199.20 g/mol.

What is the IUPAC Name of the compound?

The IUPAC Name is 11-oxo-1-azatricyclo[6.3.1.0 4,12]dodeca-4,6,8(12),9-tetraene-10-carbaldehyde.

What is the InChIKey of the compound?

The InChIKey is BHQKLXHVZPNJJF-UHFFFAOYSA-N.

How many hydrogen bond acceptor counts does the compound have?

The compound has 2 hydrogen bond acceptor counts.

What is the XLogP3-AA value of the compound?

The XLogP3-AA value is 1.2.

What is the topological polar surface area of the compound?

The topological polar surface area is 37.4Ų.

Does the compound have any defined atom stereocenter count?

No, the compound does not have any defined atom stereocenter count.

How many rotatable bond counts does the compound have?

The compound has 1 rotatable bond count.

Is the compound canonicalized?

Yes, the compound is canonicalized.