626-35-7 Purity
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Specification
The molecular formula of Coumarin 339 is C13H13NO2.
Coumarin 339 was created on 2005-03-26 and last modified on 2023-12-30.
The IUPAC Name of Coumarin 339 is 4-methyl-6,7,8,9-tetrahydropyrano[3,2-g]quinolin-2-one.
The InChIKey of Coumarin 339 is PZTQNUMZYIQRGY-UHFFFAOYSA-N.
The molecular weight of Coumarin 339 is 215.25 g/mol.
The Canonical SMILES representation of Coumarin 339 is CC1=CC(=O)OC2=C1C=C3CCCNC3=C2.
The CAS number of Coumarin 339 is 62669-73-2.
Coumarin 339 has 3 hydrogen bond acceptors.
The topological polar surface area of Coumarin 339 is 38.3 Å2.
Yes, Coumarin 339 is a canonicalized compound.