Coumarin

Catalog Number

ACM91645-1

CAS

91-64-5

Structure

Synonyms

5,6-Benzo-2-pyrone

IUPAC Name

Chromen-2-one

Molecular Weight

146.14

Molecular Formula

C9H6O2

Description

Coumarin is the primary bioactive ingredient in Radix Glehniae, named Beishashen in China, which possesses many pharmacological activities, including anticancer, anti-inflammation and antivirus activities.

Canonical SMILES

C1=CC=C2C(=C1)C=CC(=O)O2

InChI

InChI=1S/C9H6O2/c10-9-6-5-7-3-1-2-4-8(7)11-9/h1-6H

InChI Key

ZYGHJZDHTFUPRJ-UHFFFAOYSA-N

Boiling Point

298 °C(lit.)

Melting Point

68-73 °C(lit.)

Flash Point

162 °C

Purity

99%

Density

0.935 g/cm³

Solubility

Freely soluble in oils

Appearance

Solid

Storage

Store below +30 °C

Packaging

1 kg

• Catalog Number: ACM91645-1
• CAS: 91-64-5
• Synonyms: 5,6-Benzo-2-pyrone
• IUPAC Name: Chromen-2-one
• Molecular Weight: 146.14
• Molecular Formula: C9H6O2
• Description: Coumarin is the primary bioactive ingredient in Radix Glehniae, named Beishashen in China, which possesses many pharmacological activities, including anticancer, anti-inflammation and antivirus activities.
• Canonical SMILES: C1=CC=C2C(=C1)C=CC(=O)O2
• InChI: InChI=1S/C9H6O2/c10-9-6-5-7-3-1-2-4-8(7)11-9/h1-6H
• InChI Key: ZYGHJZDHTFUPRJ-UHFFFAOYSA-N
• Boiling Point: 298 °C(lit.)
• Melting Point: 68-73 °C(lit.)
• Flash Point: 162 °C
• Purity: 99%
• Density: 0.935 g/cm³
• Solubility: Freely soluble in oils
• Appearance: Solid
• Storage: Store below +30 °C
• Packaging: 1 kg