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Name |
Quinoline-4-carbonitrile |
EINECS | N/A |
CAS No. | 2973-27-5 | Density | 1.21 g/cm3 |
PSA | 36.68000 | LogP | 2.10648 |
Solubility | N/A | Melting Point |
103-104oC |
Formula | C10H6N2 | Boiling Point | 243.2 °C at 760 mmHg |
Molecular Weight | 154.171 | Flash Point | 95.2 °C |
Transport Information | N/A | Appearance | White to off-white microcrystalline solid |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
Cinchoninonitrile(6CI,7CI,8CI);4-Cyanoquinoline;NSC 113049; |
Article Data | 5 |
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