Structure

Coumarin 510

CAS
87349-92-6
Catalog Number
ACM87349926-1
Category
Other Products
Molecular Weight
318.38
Molecular Formula
C20H18N2O2

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Specification

Description
Alfa Chemistry offers high-purity Coumarin 510 products for various research purposes. Please contact us by email if you do not find the specification you are looking for on this page.
Synonyms
2,3,6,7-Tetrahydro-10-(3-pyridyl)-1H,5H,11H-[1]benzopyrano[6,7,8-ij]quinolizin-11-one
IUPAC Name
5-pyridin-3-yl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one
Canonical SMILES
C1CC2=C3C(=C4C(=C2)C=C(C(=O)O4)C5=CN=CC=C5)CCCN3C1
InChI
InChI=1S/C20H18N2O2/c23-20-17(14-4-1-7-21-12-14)11-15-10-13-5-2-8-22-9-3-6-16(18(13)22)19(15)24-20/h1,4,7,10-12H,2-3,5-6,8-9H2
InChI Key
OEEAIIVRKIVRNX-UHFFFAOYSA-N
Boiling Point
596.9 ± 50.0 °C
Melting Point
163.0 to 167.0 °C
Density
1.35 ± 0.1 g/ml
Appearance
Light yellow to Amber to Dark green powder to crystal
Application
Such coumarin dyes are useful for laser dyes emitting blue-green light.
Storage
-20 °C in the dark
Absorption Wavelength
(max.) 418(CH3CN) nm
Complexity
546
Covalently-Bonded Unit Count
1
Exact Mass
318.136828g/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
0
H-Bond Acceptor
4
H-Bond Donor
0
Heavy Atom Count
24
MDL Number
MFCD00467042
Molar Extinction Coefficient
min. 34000(THF, 412 to 417nm)
Monoisotopic Mass
318.136828g/mol
Packaging
200MG-Glass Bottle with Plastic Insert
Physical State
(20 deg.C) Solid
Rotatable Bond Count
1
Storage Conditions
Store at room temperature and dry
XLogP3
3.4
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