2,4-Pentadienal

• Catalog Number: ACM764409
• Product Name: 2,4-Pentadienal
• CAS: 764-40-9
• Category: Heterocyclic Organic Compound
• Synonyms: 1,3-Pentadiene-5-one
• IUPAC Name: (2E)-Penta-2,4-dienal
• Molecular Weight: 82.1
• Molecular Formula: C₅H₆O
• Canonical SMILES: C=CC=CC=O
• InChI: InChI=1S/C5H6O/c1-2-3-4-5-6/h2-5H,1H2/b4-3+
• InChI Key: PPXGQLMPUIVFRE-ONEGZZNKSA-N
• Boiling Point: 36-37 °C
• Density: 0.845±0.06 g/cm³
• Solubility: Soluble in oils
• Exact Mass: 82.041864811
• Isomeric SMILES: C=C/C=C/C=O
• Monoisotopic Mass: 82.041864811
• Odor: Fruity aroma
• Physical State: Liquid
• Topological Polar Surface Area: 17.1 Ų

Custom Q&A

What is the molecular formula of 2,4-Pentadienal?

The molecular formula of 2,4-Pentadienal is C5H6O.

What is the molecular weight of 2,4-Pentadienal?

The molecular weight of 2,4-Pentadienal is 82.10 g/mol.

What is the IUPAC name of 2,4-Pentadienal?

The IUPAC name of 2,4-Pentadienal is (2E)-penta-2,4-dienal.

What is the InChI of 2,4-Pentadienal?

The InChI of 2,4-Pentadienal is InChI=1S/C5H6O/c1-2-3-4-5-6/h2-5H,1H2/b4-3+.

What is the InChIKey of 2,4-Pentadienal?

The InChIKey of 2,4-Pentadienal is PPXGQLMPUIVFRE-ONEGZZNKSA-N.

What is the canonical SMILES of 2,4-Pentadienal?

The canonical SMILES of 2,4-Pentadienal is C=CC=CC=O.

What is the isomeric SMILES of 2,4-Pentadienal?

The isomeric SMILES of 2,4-Pentadienal is C=C/C=C/C=O.

What is the CAS number of 2,4-Pentadienal?

The CAS number of 2,4-Pentadienal is 20432-40-0.

What is the FEMA number of 2,4-Pentadienal?

The FEMA number of 2,4-Pentadienal is 3217.

What is the XLogP3-AA value of 2,4-Pentadienal?

The XLogP3-AA value of 2,4-Pentadienal is 1.