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4-Quinolinecarbonitrile (2973-27-5)

Identification
Name:4-Quinolinecarbonitrile
Synonyms:Cinchoninonitrile(6CI,7CI,8CI);4-Cyanoquinoline;NSC 113049;
CAS:2973-27-5
Molecular Formula: C10H6N2
Molecular Weight: 154.168
InChI: InChI=1/C10H6N2/c11-7-8-5-6-12-10-4-2-1-3-9(8)10/h1-6H
Molecular Structure: (C10H6N2) Cinchoninonitrile(6CI,7CI,8CI);4-Cyanoquinoline;NSC 113049;
Properties
Melting Point: 103-104 ºC
Density:1.21 g/cm3
Refractive index:1.654
Appearance:White to off-white microcrystalline solid
Specification:

The CAS register number of Quinoline-4-carbonitrile is 2973-27-5. It also can be called as Cinchoninonitrile and the IUPAC name about this chemical is quinoline-4-carbonitrile. The molecular formula about this chemical is C10H6N2 and molecular weight is 154.17.

Physical properties about Quinoline-4-carbonitrile are: (1)ACD/LogP: 1.98; (2)#H bond acceptors: 2; (3)Polar Surface Area: 36.68Å2; (4)Index of Refraction: 1.654; (5)Molar Refractivity: 46.67 cm3; (6)Molar Volume: 127.2 cm3; (7)Polarizability: 18.5x10-24cm3; (8)Surface Tension: 59.4 dyne/cm; (9)Enthalpy of Vaporization: 48.02 kJ/mol; (10)Boiling Point: 243.2 °C at 760 mmHg; (11)Vapour Pressure: 0.0325 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: N#Cc1c2ccccc2ncc1
(2)InChI: InChI=1/C10H6N2/c11-7-8-5-6-12-10-4-2-1-3-9(8)10/h1-6H
(3)InChIKey: JBSAUEMFOKUWTP-UHFFFAOYAY
(4)Std. InChI: InChI=1S/C10H6N2/c11-7-8-5-6-12-10-4-2-1-3-9(8)10/h1-6H
(5)Std. InChIKey: JBSAUEMFOKUWTP-UHFFFAOYSA-N

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