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65610-14-2

Basic Information
CAS No.: 65610-14-2
Name: 4-FLUOROPHTHALONITRILE
Article Data: 3
Molecular Structure:
Molecular Structure of 65610-14-2 (4-FLUOROPHTHALONITRILE)
Formula: C8H3FN2
Molecular Weight: 146.124
Synonyms: 4-Fluoro-1,2-benzenedicarbonitrile;4-Fluorophthalonitrile;
EINECS: -0
Density: 1.27 g/cm3
Melting Point: 100-104 °C
Boiling Point: 303.7 °C at 760 mmHg
Flash Point: 137.5 °C
Appearance: light yellow crystall powder
Hazard Symbols: VeryT+
Risk Codes: 28
Safety: 28-36/37-45
Transport Information: UN 2811 6.1/PG 2
PSA: 47.58000
LogP: 1.56906
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Chemistry

IUPAC Name: 4-Fluorobenzene-1,2-dicarbonitrile
Synonyms of 4-Fluorobenzene-1,2-dicarbonitrile (CAS NO.65610-14-2): 1,2-Benzenedicarbonitrile, 4-fluoro-
CAS NO: 65610-14-2
Molecular Formula: C8H3FN2
Molecular Weight: 146.1212
Molecular Structure:
H bond acceptors: 2
H bond donors: 0
Freely Rotating Bonds: 0
Polar Surface Area: 47.58 Å2
Index of Refraction: 1.538
Molar Refractivity: 36 cm3
Molar Volume: 114.9 cm3
Surface Tension: 51.5 dyne/cm
Density: 1.27 g/cm3
Flash Point: 137.5 °C
Enthalpy of Vaporization: 54.4 kJ/mol
Boiling Point: 303.7 °C at 760 mmHg
Vapour Pressure: 0.000917 mmHg at 25°C
Melting Point: 100-104 °C
Appearance: white crystalline powder
SMILES: N#Cc1c(C#N)cc(F)cc1
InChI: InChI=1/C8H3FN2/c9-8-2-1-6(4-10)7(3-8)5-11/h1-3H
InChIKey: QQEKYCCJLSRLEC-UHFFFAOYAH
Std. InChI: InChI=1S/C8H3FN2/c9-8-2-1-6(4-10)7(3-8)5-11/h1-3H
Std. InChIKey: QQEKYCCJLSRLEC-UHFFFAOYSA-N
Product Categories of 4-Fluorobenzene-1,2-dicarbonitrile (CAS NO.65610-14-2): HALIDE;NITRILE;Aromatic Cinnamic Acids, Esters and Derivatives

Safety Profile

Hazard Codes:VeryT+
Risk Statements: 28
R28: 4-Fluorobenzene-1,2-dicarbonitrile (CAS NO.65610-14-2) is very toxic if swallowed.
Safety Statements: 28-36/37-45
S28: After contact with skin, wash immediately with plenty of soap-suds. 
S36/37: Wear suitable protective clothing and gloves. 
S45: In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.)
RIDADR: UN 2811 6.1/PG 2
WGK Germany: 3
RTECS: CZ1942750
Hazard Note: Harmful
HazardClass: 6.1
PackingGroup: II