Scopoletin

Suppliers

Names

[ CAS No. ]:
92-61-5

[ Name ]:
Scopoletin

[Synonym ]:
7-hydroxy-6-methoxychromen-2-one
7-Hydroxy-6-methoxycoumarin
Scopoletine
Esculetin-6-methyl ether
6-Methylesculetin
6-Methoxyumbelliferone
Escopoletin
6-methoxy-7-hydroxy-coumarin
2H-1-Benzopyran-2-one, 7-hydroxy-6-methoxy-
Chrysatropic acid
Scopoletin
Gelseminic Acid
MFCD00006872
7-hydroxy-6-methoxy-2H-benzopyran-2-one
7-hydroxy-6-methoxy-2H-1-benzopyran-2-one
Scopoletol
EINECS 202-171-9
β-Methylesculetin
6-O-Methylesculetin
7-Hydroxy-6-methoxy-2H-chromen-2-one
b-Methylesculetin
Murrayetin
7-Hydroxy-5-methoxycoumarin

Chemical & Physical Properties

[ Density]:
1.4±0.1 g/cm3

[ Boiling Point ]:
413.5±45.0 °C at 760 mmHg

[ Melting Point ]:
203-205 °C(lit.)

[ Molecular Formula ]:
C₁₀H₈O₄

[ Molecular Weight ]:
192.168

[ Flash Point ]:
172.4±22.2 °C

[ Exact Mass ]:
192.042252

[ PSA ]:
59.67000

[ LogP ]:
1.28

[ Vapour Pressure ]:
0.0±1.0 mmHg at 25°C

[ Index of Refraction ]:
1.609

[ Storage condition ]:
-20°C Freezer

[ Water Solubility ]:
Slightly soluble

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: GN6930000

CHEMICAL NAME :: Coumarin, 7-hydroxy-6-methoxy-

CAS REGISTRY NUMBER :: 92-61-5

BEILSTEIN REFERENCE NO. :: 0156296

LAST UPDATED :: 199612

DATA ITEMS CITED :: 2

MOLECULAR FORMULA :: C10-H8-O4

MOLECULAR WEIGHT :: 192.18

WISWESSER LINE NOTATION :: T66 BOVJ HO1 IQ

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: 3800 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: AIPTAK Archives Internationales de Pharmacodynamie et de Therapie. (Heymans Institute of Pharmacology, De Pintelaan 185, B-9000 Ghent, Belgium) V.4- 1898- Volume(issue)/page/year: 210,27,1974

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 350 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 18,1330,1968

Safety Information

[ Symbol ]:

GHS07

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H315-H319-H335

[ Precautionary Statements ]:
P261-P305 + P351 + P338

[ Personal Protective Equipment ]:
dust mask type N95 (US);Eyeshields;Gloves

[ Hazard Codes ]:
Xi: Irritant;

[ Risk Phrases ]:
R36/37/38

[ Safety Phrases ]:
S26-S36-S37/39

[ RIDADR ]:
NONH for all modes of transport

[ WGK Germany ]:
2

[ RTECS ]:
GN6930000

[ HS Code ]:
2932209090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

Scopoletin acetate
6,7-Dihydroxycoumarin
methyl iodide
Z-4,5-dimethoxy-2-prenyloxycinnamic acid
scopolin
2,4-dihydroxy-5-Methoxybenzaldehyde
Ethyl 2-(triphenylphosphoranylidene)acetate
2,4,5-Trimethoxybenzaldehyde

DownStream

scopolin
Fraxetin
6,7-Dihydroxycoumarin
methyl iodide
Scoparone
2,4-dihydroxy-5-methoxybenzoic acid
7-[(3,3-dimethyloxiran-2-yl)methoxy]-6-methoxychromen-2-one
7-hydroxy-6-methoxy-3,4-dihydrochromen-2-one
Braylin

Customs

[ HS Code ]: 2932209090

[ Summary ]:
2932209090. other lactones. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

Articles

[Study on the chemical constituents of the roots of Dendropanax chevalieri].

Zhong Yao Cai 35(1) , 62-4, (2012)

To study the chemical constituents of the roots of Dendropanax chevalieri.The constituents were isolated by column chromatography with silica gel, Sephadex LH-20 gel and RP-18. Their structures were e...

Viola mandshurica ethanolic extract prevents high-fat-diet-induced obesity in mice by activating AMP-activated protein kinase.

Environ. Toxicol. Pharmacol. 38(1) , 41-50, (2014)

Viola mandshurica W. Becker has been used as an expectorant, diuretic, and anti-inflammatory agent. We evaluated the effects of V. mandshurica ethanol extract (VME) on high-fat-diet (HFD)-induced obes...

Photochemical production of hydrogen peroxide from natural algicides: decomposition organic matter from straw.

Environ. Sci. Process. Impacts 17 , 1455-61, (2015)

The ability of decomposition organic matter from three natural algicides (barley, rice, and wheat straw) and natural organic matter (NOM) isolates to generate hydrogen peroxide under simulated solar i...