1-CYANO-4-FLUORONAPHTHALENE

The 1-Naphthalenecarbonitrile,4-fluoro-, with CAS registry number 13916-99-9, has the systematic name of 4-fluoronaphthalene-1-carbonitrile. Besides this, it is also called 1-Cyano-4-fluoronaphthalene. This chemical is instability under normal temperature and pressure conditions. And the chemical formula of this chemical is C₁₁H₆FN.

Physical properties of 1-Naphthalenecarbonitrile,4-fluoro-: (1)ACD/LogP: 2.93; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.93; (4)ACD/LogD (pH 7.4): 2.93; (5)ACD/BCF (pH 5.5): 98.81; (6)ACD/BCF (pH 7.4): 98.81; (7)ACD/KOC (pH 5.5): 932.16; (8)ACD/KOC (pH 7.4): 932.16; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 23.79 Å²; (13)Index of Refraction: 1.621; (14)Molar Refractivity: 48.98 cm³; (15)Molar Volume: 139.1 cm³; (16)Polarizability: 19.42×10^-24cm³; (17)Surface Tension: 47.4 dyne/cm; (18)Density: 1.22 g/cm³; (19)Flash Point: 156.3 °C; (20)Enthalpy of Vaporization: 55.61 kJ/mol; (21)Boiling Point: 314.9 °C at 760 mmHg; (22)Vapour Pressure: 0.000452 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
The 1-Naphthalenecarbonitrile,4-fluoro- is harmful by inhalation, in contact with skin and if swallowed. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: N#Cc2c1ccccc1c(F)cc2
(2)InChI: InChI=1/C11H6FN/c12-11-6-5-8(7-13)9-3-1-2-4-10(9)11/h1-6H
(3)InChIKey: XQSGYYNFKIQWAC-UHFFFAOYAY
(4)Std. InChI: InChI=1S/C11H6FN/c12-11-6-5-8(7-13)9-3-1-2-4-10(9)11/h1-6H
(5)Std. InChIKey: XQSGYYNFKIQWAC-UHFFFAOYSA-N