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Ethyl 5,6-Benzocoumarin-3-Carboxylate
[CAS# 734-88-3]

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Identification
Name Ethyl 5,6-Benzocoumarin-3-Carboxylate
Synonyms 3-Oxo-2-Benzo[F]Chromenecarboxylic Acid Ethyl Ester; 3-Ketobenzo[F]Chromene-2-Carboxylic Acid Ethyl Ester; St5171059
Molecular Structure CAS#: 734-88-3, Ethyl 5,6-Benzocoumarin-3-Carboxylate
Molecular Formula C16H12O4
Molecular Weight 268.27
CAS Registry Number 734-88-3
EINECS 211-997-9
SMILES C1=CC3=C(C2=C1OC(C(=C2)C(=O)OCC)=O)C=CC=C3
InChI 1S/C16H12O4/c1-2-19-15(17)13-9-12-11-6-4-3-5-10(11)7-8-14(12)20-16(13)18/h3-9H,2H2,1H3
InChIKey FYOZSKRVTISLHE-UHFFFAOYSA-N
Properties
Density 1.319g/cm3 (Cal.)
Boiling point 473.047°C at 760 mmHg (Cal.)
Flash point 247.89°C (Cal.)
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