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7-Methylcoumarin Structure

7-Methylcoumarin

Chemical Properties

Melting point 128-130 °C (lit.)
Boiling point 171-172 °C/11 mmHg (lit.)
Density  1.0924 (rough estimate)
refractive index  1.5300 (estimate)
storage temp.  Store at -20°C
form  Solid
color  White to off-white
Odor at 100.00 %. sweet coumarin tonka coconut powdery
Odor Type tonka
InChI 1S/C10H8O2/c1-7-2-3-8-4-5-10(11)12-9(8)6-7/h2-6H,1H3
InChIKey DLHXRDUXNVEIEY-UHFFFAOYSA-N
SMILES Cc1ccc2C=CC(=O)Oc2c1
LogP 2.274 (est)
CAS DataBase Reference 2445-83-2(CAS DataBase Reference)
EPA Substance Registry System 2H-1-Benzopyran-2-one, 7-methyl- (2445-83-2)

Safety Information

Risk Statements  23/24/25
Safety Statements  1-13-45
WGK Germany  2
RTECS  GN7792100
TSCA  TSCA listed
HS Code  2932209088
Storage Class 11 - Combustible Solids
Toxicity mouse,LD50,subcutaneous,258mg/kg (258mg/kg),BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD,Yakugaku Zasshi. Journal of Pharmacy. Vol. 76, Pg. 186, 1956.

MSDS

Usage And Synthesis

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