4-[(3,4-Dichlorobenzyl)oxy]-3-ethoxybenzaldehyde

• Catalog Number: ACMA00002986
• Category: Ethers
• Molecular Weight: 325.19
• Molecular Formula: C₁₆H₁₃NO₃
• Hazard Statements: H318
• RIDADR: NONH for all modes of transport
• Symbol: GHS05

Custom Q&A

What is the molecular formula of the compound?

The molecular formula of the compound is C16H14Cl2O3.

When was the compound created and modified?

The compound was created on July 9, 2005, and modified on November 25, 2023.

What is the IUPAC name of the compound?

The IUPAC name of the compound is 4-[(3,4-dichlorophenyl)methoxy]-3-ethoxybenzaldehyde.

What is the Canonical SMILES of the compound?

The Canonical SMILES of the compound is CCOC1=C(C=CC(=C1)C=O)OCC2=CC(=C(C=C2)Cl)Cl.

What is the InChIKey of the compound?

The InChIKey of the compound is QZUPJJPYQKOZGW-UHFFFAOYSA-N.

What is the exact mass of the compound?

The exact mass of the compound is 324.0319997 g/mol.

How many hydrogen bond donor counts are in the compound?

There are 0 hydrogen bond donor counts in the compound.

What is the topological polar surface area of the compound?

The topological polar surface area of the compound is 35.5Ų.

How many rotatable bond counts are in the compound?

There are 6 rotatable bond counts in the compound.

Is the compound canonicalized?

Yes, the compound is canonicalized.