1-(3-Bromo-4-methoxyphenyl)ethanone

• Catalog Number: ACMA00000860
• Category: Amines
• Molecular Weight: 229.07
• Molecular Formula: C₁₀H₁₃N
• Hazard Statements: H302
• RIDADR: NONH for all modes of transport
• Symbol: GHS07

Custom Q&A

What is the molecular formula of the compound?

The molecular formula is C9H9BrO2.

What is the molecular weight of the compound?

The molecular weight is 229.07 g/mol.

What is the IUPAC name of the compound?

The IUPAC name is 1-(3-bromo-4-methoxyphenyl)ethanone.

What is the InChI of the compound?

The InChI is InChI=1S/C9H9BrO2/c1-6(11)7-3-4-9(12-2)8(10)5-7/h3-5H,1-2H3.

What is the InChIKey of the compound?

The InChIKey is JYPGOBDETCKKKV-UHFFFAOYSA-N.

What is the canonical SMILES of the compound?

The canonical SMILES is CC(=O)C1=CC(=C(C=C1)OC)Br.

What is the CAS number of the compound?

The CAS number is 35310-75-9.

What is the European Community (EC) number of the compound?

The EC number is 673-347-4.

What is the XLogP3-AA value of the compound?

The XLogP3-AA value is 2.3.

Is the compound canonicalized?

Yes, the compound is canonicalized.