Isobonducellin

CAS	610778-85-3
Structure
Synonyms	(3Z)-2,3-Dihydro-7-hydroxy-3-[(4-methoxyphenyl)methylene]-4H-1-benzopyran-4-one
IUPAC Name	(3Z)-7-hydroxy-3-[(4-methoxyphenyl)methylidene]chromen-4-one
Molecular Weight	282.29
Molecular Formula	C17H14O4
Canonical SMILES	COC1=CC=C(C=C1)/C=C\2/COC3=C(C2=O)C=CC(=C3)O
InChI	InChI=1S/C17H14O4/c1-20-14-5-2-11(3-6-14)8-12-10-21-16-9-13(18)4-7-15(16)17(12)19/h2-9,18H,10H2,1H3/b12-8-
InChI Key	DLQSYZMPSWHYMW-WQLSENKSSA-N
Boiling Point	526.3±50.0 °C
Melting Point	156-158 °C
Purity	98%
Density	1.318±0.06 g/ml
pKa	7.58±0.20
Appearance	Solid