3-Nitrophthalonitrile

Chemical Properties

Melting point	162-165 °C (lit.)
Boiling point	386.1±37.0 °C(Predicted)
Density	1.41±0.1 g/cm3(Predicted)
vapor pressure	0Pa at 20-25℃
storage temp.	room temp
solubility	Methanol[soluble in]
form	Powder
color	White to Light yellow to Green
Water Solubility	Soluble in methanol. Insoluble in water.
BRN	2263686
InChI	InChI=1S/C8H3N3O2/c9-4-6-2-1-3-8(11(12)13)7(6)5-10/h1-3H
InChIKey	UZJZIZFCQFZDHP-UHFFFAOYSA-N
SMILES	C1(C#N)=CC=CC([N+]([O-])=O)=C1C#N
LogP	0.3 at 25℃
Surface tension	70.3mN/m at 212.5mg/L and 25℃
CAS DataBase Reference	51762-67-5(CAS DataBase Reference)
EPA Substance Registry System	1,2-Benzenedicarbonitrile, 3-nitro- (51762-67-5)