4-(5-(4-(pentyloxy)phenyl)isoxazol-3-yl)benzoic acid

Chemical Properties

Melting point	271-273oC
Boiling point	555.6±50.0 °C(Predicted)
Density	1.176±0.06 g/cm3(Predicted)
storage temp.	Sealed in dry,Room Temperature
solubility	Acetone (Slightly, Heated), DMSO (Slightly)
pka	3.72±0.10(Predicted)
form	Solid
color	White
InChI	InChI=1S/C21H21NO4/c1-2-3-4-13-25-18-11-9-16(10-12-18)20-14-19(22-26-20)15-5-7-17(8-6-15)21(23)24/h5-12,14H,2-4,13H2,1H3,(H,23,24)
InChIKey	PDTXSIGPZDVVIX-UHFFFAOYSA-N
SMILES	C(O)(=O)C1=CC=C(C2C=C(C3=CC=C(OCCCCC)C=C3)ON=2)C=C1

HS Code

2934999090

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