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Chemical structure of 6,7-Diethoxy-4-methylcoumarin

GC76120

6,7-Diethoxy-4-methylcoumarin

Also known as 6,7-diethoxy-4-methylchromen-2-one

6,7-Diethoxy-4-methylcoumarin is a fluorogenic substrate and is also a metabolite of Cordyceps militaris

ChemicalCAS314744-06-4MW248.27FormulaC14H16O4
CAS number
314744-06-4
Molecular weight
248.27
Formula
C14H16O4
Solubility
DMSO： 33·33 mg/mL (134·25 mM; ultrasonic and warming and heat to 60°C)
InChIKey
BVALWPRSDDHKIU-UHFFFAOYSA-N
Catalogue number
GC76120
Brand
GLPBIO
Computed properties PubChem CID 688976 · XLogP 2.5 · TPSA 44.8 Ų · H-bond donors 0
XLogP
2.5
TPSA
44.8 Ų
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
18

SMILES CCOC1=C(C=C2C(=C1)C(=CC(=O)O2)C)OCC

Computed descriptors from PubChem (CID 688976), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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