4-Carboxymethyl-6,7-methylenedioxycoumarin

Catalog Number

ACM97744779-1

CAS

97744-77-9

Structure

Synonyms

2-(6-oxo-[1,3]dioxolo[4,5-g]chromen-8-yl)aceticacid;2-(6-Oxo-6H-[1,3]dioxolo[4,5-g]chromen-8-yl)aceticacid

IUPAC Name

2-(6-oxo-[1,3]dioxolo[4,5-g]chromen-8-yl)aceticacid

Molecular Weight

248.19

Molecular Formula

C12H8O6

Canonical SMILES

C1OC2=C(O1)C=C3C(=C2)C(=CC(=O)O3)CC(=O)O

InChI

InChI=1S/C12H8O6/c13-11(14)1-6-2-12(15)18-8-4-10-9(3-7(6)8)16-5-17-10/h2-4H,1,5H2,(H,13,14)

InChI Key

PIHRLFGNZWHKIO-UHFFFAOYSA-N

Melting Point

195 °C

Purity

≥97%

Appearance

Powder or solid

Storage

-20 °C in the dark

• Catalog Number: ACM97744779-1
• CAS: 97744-77-9
• Synonyms: 2-(6-oxo-[1,3]dioxolo[4,5-g]chromen-8-yl)aceticacid;2-(6-Oxo-6H-[1,3]dioxolo[4,5-g]chromen-8-yl)aceticacid
• IUPAC Name: 2-(6-oxo-[1,3]dioxolo[4,5-g]chromen-8-yl)aceticacid
• Molecular Weight: 248.19
• Molecular Formula: C12H8O6
• Canonical SMILES: C1OC2=C(O1)C=C3C(=C2)C(=CC(=O)O3)CC(=O)O
• InChI: InChI=1S/C12H8O6/c13-11(14)1-6-2-12(15)18-8-4-10-9(3-7(6)8)16-5-17-10/h2-4H,1,5H2,(H,13,14)
• InChI Key: PIHRLFGNZWHKIO-UHFFFAOYSA-N
• Melting Point: 195 °C
• Purity: ≥97%
• Appearance: Powder or solid
• Storage: -20 °C in the dark