CAS 87331-48-4 Coumarin 498 - Materials / Alfa Chemistry

NAVIGATION

Coumarin 498

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Catalog Number

ACM87331484-1

CAS Number

87331-48-4

Product Name

Coumarin 498

Structure

Category

Coumarin Dyes; Other Materials

Synonyms

2,3,6,7-Tetrahydro-10-(methylsulfonyl)-1H,5H,11H-[1]benzopyrano[6,7,8-ij]quinolizin-11-one

Description

Alfa Chemistry offers high-purity Coumarin 498 products for various research purposes. Please contact us by email if you do not find the specification you are looking for on this page.

IUPAC Name

5-methylsulfonyl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one

Molecular Weight

319.38

Molecular Formula

C16H17NO4S

Canonical SMILES

CS(=O)(=O)C1=CC2=CC3=C4C(=C2OC1=O)CCCN4CCC3

InChI

InChI=1S/C16H17NO4S/c1-22(19,20)13-9-11-8-10-4-2-6-17-7-3-5-12(14(10)17)15(11)21-16(13)18/h8-9H,2-7H2,1H3

InChI Key

DPJWIXMOCGJKDG-UHFFFAOYSA-N

Melting Point

193 °C

Purity

>98.0%(HPLC)

Appearance

Light yellow to Yellow to Orange powder to crystal

Application

Such coumarin dyes are useful for laser dyes emitting blue-green light.

Storage

-20 °C in the dark

Complexity

621

Composition

(Nitrogen) 4.00 to 4.60 %

Covalently-Bonded Unit Count

Exact Mass

319.087829g/mol

Features And Benefits

Coumarins are aromatic lactone compounds, many of which are found in natural plants. Coumarin compounds having an electron donating group at the 7-position show strong light absorption and emission, whereas unsubstituted coumarin compounds hardly emit light. This is because intramolecular charge transfer occurs when both electron-donating and electron-withdrawing groups are present in the coumarin molecule. The introduction of groups at the 3- or 4-position largely controls the wavelength of light absorption and emission. Furthermore, the introduction of electron-withdrawing groups at these positions can enhance the luminescence intensity.

Formal Charge

Heavy Atom Count

Monoisotopic Mass

319.087829g/mol

Rotatable Bond Count

Storage Conditions

Store at room temperature and dry

XLogP3

2.3

MSDS

Download MSDS

COA