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7-Ethoxy-4-methyl-2H-chromen-2-one

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7-Ethoxy-4-methyl-2H-chromen-2-one Basic information

Product Name:
7-Ethoxy-4-methyl-2H-chromen-2-one
Synonyms:
  • ETHYL 4-METHYLUMBELLIFERYL ETHER
  • TIMTEC-BB SBB010011
  • 7-ETHOXY-4-METHYLCOUMARIN, FOR FLUORESCE NCE
  • Maraniol
  • 7-Ethoxy-4-methylcoumarin 98%
  • METHYL-7-ETHOXYCOUMARIN, 4-(SG)
  • 4-Methyl-7-ethoxy-2H-1-benzopyran-2-one
  • 7-Ethoxy-4-methyl-2H-1-benzopyran-2-one
CAS:
87-05-8
MF:
C12H12O3
MW:
204.22
EINECS:
201-721-5
Product Categories:
  • Coumarins
  • API intermediates
Mol File:
87-05-8.mol
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7-Ethoxy-4-methyl-2H-chromen-2-one Chemical Properties

Melting point:
114-116 °C (lit.)
Boiling point:
351.4±37.0 °C(Predicted)
Density 
1.163±0.06 g/cm3(Predicted)
storage temp. 
-20°C Freezer, Under inert atmosphere
solubility 
DMF: soluble
form 
Solid
color 
White to Off-White
Odor
at 100.00 %. nutty walnut
Odor Type
nutty
BRN 
169998
LogP
2.973 (est)
CAS DataBase Reference
87-05-8(CAS DataBase Reference)
NIST Chemistry Reference
4-Methyl-7-ethoxycoumarin(87-05-8)
EPA Substance Registry System
2H-1-Benzopyran-2-one, 7-ethoxy-4-methyl- (87-05-8)
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Safety Information

Hazard Codes 
Xi
Safety Statements 
24/25
WGK Germany 
3
8
Hazard Note 
Irritant
TSCA 
Yes
HS Code 
29322090

MSDS

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7-Ethoxy-4-methyl-2H-chromen-2-one Usage And Synthesis

Chemical Properties

White solid; walnut odor. Slightly soluble in alcohol.

Uses

Perfumery, flavoring.

Uses

7-Ethoxy-4-methylcoumarin was an analyte in a study of the structural characterization and retention time simulation of allergenic fragrances.

Uses

7-Ethoxy-4-methylcoumarin may be used in the assay of 4-chlormethyl-7-ethoxycoumarin O-deethylase activity.

Definition

ChEBI: 7-Ethoxy-4-methyl-2H-1-benzopyran-2-one is a member of coumarins.

General Description

7-Ethoxy-4-methylcoumarin (EtOMC), also known as ethyl 4-methylumbelliferyl ether, is a coumarin derivative. Its standard molar energy of combustion is ?5888.0 ± 3.2kJ·mol?1 and standard molar enthalpy of formation in the crystalline phase is ?545.4 ± 3.6kJ·mol?1.EtOMC can be prepared by reacting methyl acetoacetate with 3-ethoxyphenol in the presence of boron trifluoride dihydrate.The fluorescence quenching of EtOMC is more effective in the presence 4-hydroxy-TEMPO (4-hydroxy-2,2,6,6-tetramethylpiperidin-1-oxyl).

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