3-Acetyl-6-bromocoumarin

CAS Registry Number®

2199-93-1
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CAS Name

3-Acetyl-6-bromocoumarin

Molecular Formula

C11H7BrO3

Molecular Mass

267.08

Cite this Page

3-Acetyl-6-bromocoumarin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=2199-93-1 (retrieved 2024-04-18) (CAS RN: 2199-93-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    219 °C

  • Density (2)

    1.70 g/cm³

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C11H7BrO3/c1-6(13)9-5-7-4-8(12)2-3-10(7)15-11(9)14/h2-5H,1H3

InChIKey

InChIKey=XFQYOFLFNKCHLG-UHFFFAOYSA-N

SMILES

C(C)(=O)C1=CC=2C(OC1=O)=CC=C(Br)C2

Canonical SMILES

O=C1OC=2C=CC(Br)=CC2C=C1C(=O)C

Other Names for this Substance

  • 2H-1-Benzopyran-2-one, 3-acetyl-6-bromo-
  • Coumarin, 3-acetyl-6-bromo-
  • 3-Acetyl-6-bromo-2H-1-benzopyran-2-one
  • 3-Acetyl-6-bromocoumarin
  • 6-Bromo-3-acetylcoumarin

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