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5,7-Dimethoxycoumarin Structure

5,7-Dimethoxycoumarin

Chemical Properties

Melting point 146-149 °C (lit.)
Boiling point 305.04°C (rough estimate)
Density  1.2607 (rough estimate)
refractive index  1.4570 (estimate)
storage temp.  Sealed in dry,Room Temperature
solubility  Acetonitrile (Slightly), Chloroform (Slightly)
form  Solid
color  White to Off-White
Merck  14,5492
Major Application food and beverages
InChI 1S/C11H10O4/c1-13-7-5-9(14-2)8-3-4-11(12)15-10(8)6-7/h3-6H,1-2H3
InChIKey NXJCRELRQHZBQA-UHFFFAOYSA-N
SMILES COc1cc(OC)c2C=CC(=O)Oc2c1
LogP 1.891 (est)
CAS DataBase Reference 487-06-9(CAS DataBase Reference)
NIST Chemistry Reference 2H-1-benzopyran-2-one, 5,7-dimethoxy-(487-06-9)
EPA Substance Registry System 2H-1-Benzopyran-2-one, 5,7-dimethoxy- (487-06-9)

Safety Information

Hazard Codes  Xi
Risk Statements  43
Safety Statements  36/37
WGK Germany  3
RTECS  GN6530000
HS Code  2932209090
Storage Class 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Oral

MSDS

Usage And Synthesis

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