31005-02-4
Product Name:
7-Ethoxycoumarin
Formula:
C11H10O3
Synonyms:
7-Ethoxy-1-benzopyran-2-one
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Beige crystalline solid; [Sigma-Aldrich MSDS] |
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Kovats Retention Index | 1754 1771 1779 |
Chemical Classes | Dyes -> Coumarin Dyes |
SAFETY INFORMATION
Precautionary Statement Codes |
P261:Avoid breathing dust/fume/gas/mist/vapours/spray. P271:Use only outdoors or in a well-ventilated area. P280:Wear protective gloves/protective clothing/eye protection/face protection. |
COMPUTED DESCRIPTORS
Molecular Weight | 190.19 g/mol |
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XLogP3 | 2.3 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 3 |
Rotatable Bond Count | 2 |
Exact Mass | 190.062994177 g/mol |
Monoisotopic Mass | 190.062994177 g/mol |
Topological Polar Surface Area | 35.5 Ų |
Heavy Atom Count | 14 |
Formal Charge | 0 |
Complexity | 247 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
7-ethoxycoumarin is a member of the class of coumarins that is umbelliferone in which the hydroxy group at position 7 is replaced by an ethoxy group. It is an aromatic ether and a member of coumarins. It is functionally related to an umbelliferone.