531-59-9

Name 7-Methoxycoumarin
CAS 531-59-9
EINECS(EC#) 208-513-3
Molecular Formula C10H8O3
MDL Number MFCD00006876
Molecular Weight 176.17
MOL File 531-59-9.mol
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Chemical Properties

Appearance beige to salmon-pinkish powder
Melting point  117-121 °C(lit.)
Boiling point  247.77°C (rough estimate)
density  1.1795 (rough estimate)
refractive index  1.4500 (estimate)
storage temp.  Sealed in dry,Room Temperature
solubility  DMF: soluble
form  Powder
color  Beige to salmon-pinkish
Odor at 100.00 %. balsam tonka sweet
biological source synthetic
Odor Type balsamic
Water Solubility  MISCIBLE
BRN  141728
Major Application flavors and fragrances
InChI 1S/C10H8O3/c1-12-8-4-2-7-3-5-10(11)13-9(7)6-8/h2-6H,1H3
InChIKey LIIALPBMIOVAHH-UHFFFAOYSA-N
SMILES COc1ccc2C=CC(=O)Oc2c1
LogP 1.821 (est)
CAS DataBase Reference 531-59-9(CAS DataBase Reference)
NIST Chemistry Reference 2H-1-benzopyran-2-one, 7-methoxy-(531-59-9)
EPA Substance Registry System 531-59-9(EPA Substance)
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Safety Data

Hazard Codes  Xi
Risk Statements 
R36/37/38:Irritating to eyes, respiratory system and skin .
Safety Statements 
S22:Do not breathe dust .
S24/25:Avoid contact with skin and eyes .
S36:Wear suitable protective clothing .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
WGK Germany  2
RTECS  DJ3100380
F  8
TSCA  Yes
HazardClass  IRRITANT
HS Code  32129000
Storage Class 11 - Combustible Solids

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Material Safety Data Sheet(MSDS)

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