6-Bromocoumarin-3-carboxylic Acid

Catalog Number

ACM2199873-1

CAS

2199-87-3

Structure

Synonyms

6-Bromocoumarin-3-carboxylicacid;6-bromo-2-oxo-2H-chromene-3-carboxylicacid

IUPAC Name

6-bromo-2-oxochromene-3-carboxylicacid

Molecular Weight

269.05

Molecular Formula

C10H5BrO4

Canonical SMILES

C1=CC2=C(C=C1Br)C=C(C(=O)O2)C(=O)O

InChI

InChI=1S/C10H5BrO4/c11-6-1-2-8-5(3-6)4-7(9(12)13)10(14)15-8/h1-4H,(H,12,13)

InChI Key

XFQHPAXNKDYMOX-UHFFFAOYSA-N

Boiling Point

439.0 ± 45.0 °C

Melting Point

195 - 198 °C

Purity

≥97%

Density

1.874 ± 0.06 g/ml

Appearance

Powder or solid

Storage

-20 °C in the dark

• Catalog Number: ACM2199873-1
• CAS: 2199-87-3
• Synonyms: 6-Bromocoumarin-3-carboxylicacid;6-bromo-2-oxo-2H-chromene-3-carboxylicacid
• IUPAC Name: 6-bromo-2-oxochromene-3-carboxylicacid
• Molecular Weight: 269.05
• Molecular Formula: C10H5BrO4
• Canonical SMILES: C1=CC2=C(C=C1Br)C=C(C(=O)O2)C(=O)O
• InChI: InChI=1S/C10H5BrO4/c11-6-1-2-8-5(3-6)4-7(9(12)13)10(14)15-8/h1-4H,(H,12,13)
• InChI Key: XFQHPAXNKDYMOX-UHFFFAOYSA-N
• Boiling Point: 439.0 ± 45.0 °C
• Melting Point: 195 - 198 °C
• Purity: ≥97%
• Density: 1.874 ± 0.06 g/ml
• Appearance: Powder or solid
• Storage: -20 °C in the dark