CAS Number91-64-5
SynonymsMFCD00006850; Kumarin; EINECS 202-086-7; Rattex; CUMARIN; chromen-2-one; COUMARINE; Coumarin
Molecular FormulaC9H6O2
Molecular Weight146.14
Purity≥99 (HPLC)%
Density1.2±0.1 g/cm3
Boiling Point298 °C (lit.)
Melting Point68-73 °C (lit.)
Appearancepowder
EINECS202-086-7
Symbol
Signal WordWarning
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 91-64-5 |
| Catalog No. | 2A-9017719 |
| Chinese Name | 香豆素 |
| Synonyms | MFCD00006850; Kumarin; EINECS 202-086-7; Rattex; CUMARIN; chromen-2-one; COUMARINE; Coumarin |
| Molecular Formula | C9H6O2 |
| Molecular Weight | 146.14 |
| Purity | ≥99 (HPLC) |
| Density | 1.2±0.1 g/cm3 |
| Boiling Point | 298 °C (lit.) |
| Melting Point | 68-73 °C (lit.) |
| Appearance | powder |
| Water Solubility | 1.7 g/L (20 ºC) |
| Storage Condition | 1. This product should be sealed and stored in a c |
| Packaging | III |
| Application | Coumarin is the main bioactive ingredient in Chinese Radix Adenophora and has various pharmacological activities such as anti-cancer, anti-inflammatory, and anti-viral. |
| EINECS | 202-086-7 |
| HTC | 2932999099 |
| PubChem ID | 24892679 |
| MDL Number | MFCD00006850 |
| SMILES | O=C1Oc2ccccc2C=C1 |
| InChI | 1S/C9H6O2/c10-9-6-5-7-3-1-2-4-8(7)11-9/h1-6H |
| InChI Key | ZYGHJZDHTFUPRJ-UHFFFAOYSA-N |
| Beilstein/REAXYS | 383644 |
| NACRES Code | NA.25 |
| UNSPSC | 12352205 |
| Hazard Symbols | 6.1 |
| MSDS | msds/17719_1_91_64_5.pdf |
| Bioactivity | 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. Related Catalog Signaling Pathways >> Others >> Others Research Areas >> Inflammation/Immunology Research Areas >> Cancer Research Areas >> Infection Natural Products >> Phenylpropanoids References [1]. Liu M, et al. Quantitative analysis of nine coumarins in rat urine and bile after oral administration of Radix Glehniae extract by high-performance liquid chromatography-electrospray ionization tandem mass spectrometry. Biomed Chromatogr. 2011 Jul;25(7):783-93. Chemical & Physical Properties Density 1.2±0.1 g/cm3 Boiling Point 298.0±0.0 °C at 760 mmHg Melting Point 68-73 °C(lit.) Molecular Formula C9H6O2 Molecular Weight 146.143 Flash Point 118.3±16.1 °C Exact Mass 146.036774 PSA 30.21000 LogP 1.39 Vapour Pressure 0.0±0.6 mmHg at 25°C Index of Refraction 1.595 InChIKey ZYGHJZDHTFUPRJ-UHFFFAOYSA-N SMILES O=c1ccc2ccccc2o1 Water Solubility 1.7 g/L (20 ºC) |
| Use of | 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. Properties Articles174 Name coumarin Synonym More Synonyms Coumarin Biological Activity 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. Related Catalog Signaling Pathways >> Others >> Others Research Areas >> Inflammation/Immunology Research Areas >> Cancer Research Areas >> Infection Natural Products >> Phenylpropanoids References [1]. Liu M, et al. Quantitative analysis of nine coumarins in rat urine and bile after oral administration of Radix Glehniae extract by high-performance liquid chromatography-electrospray ionization tandem mass spectrometry. Biomed Chromatogr. 2011 Jul;25(7):783-93. Chemical & Physical Properties Molecular Formula C9H6O2 Exact Mass 146.036774 PSA 30.21000 Index of Refraction 1.595 InChIKey ZYGHJZDHTFUPRJ-UHFFFAOYSA-N |
| Tax Rebate | 13.0% |
| Supervision | None Minimum tariff: 6.5% General tariff: 20.0% |
| Transport Info | Product name: Purity: 98.0% |
| MSDS Transport Info | Module 14. Shipping information United Nations classification: Item 1 Poisons. UN number: 2811 Proper Shipping Name: Toxic Solid, Organic, Not Otherwise Specified Packing grade: III |
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