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5467-79-8

Basic Information
CAS No.: 5467-79-8
Name: 6-METHOXY-2-QUINOLINECARBONITR
Article Data: 20
Molecular Structure:
Molecular Structure of 5467-79-8 (6-METHOXY-2-QUINOLINECARBONITR)
Formula: C11H8N2O
Molecular Weight: 184.197
Synonyms: Quinaldonitrile, 6-methoxy- (6CI,7CI,8CI);2-Cyano-6-methoxyquinoline;6-Methoxy-2-quinolinecarbonitrile;NSC 25415;
Density: 1.23 g/cm3
Melting Point: 175-179 °C
Boiling Point: 362.2 °C at 760 mmHg
Flash Point: 172.9 °C
Hazard Symbols: HarmfulXn
Risk Codes: 22-41
Safety: 26-39
PSA: 45.91000
LogP: 2.11508
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Specification

The 2-Quinolinecarbonitrile,6-methoxy- is an organic compound with the formula C11H8N2O. The IUPAC name of this chemical is 6-Methoxyquinoline-2-carbonitrile. With the CAS registry number 5467-79-8, it is also named as 2-Cyano-6-methoxyquinoline. Besides, its molecular weight is 184.194.

The physical properties of 2-Quinolinecarbonitrile,6-methoxy- are: (1)ACD/LogP: 1.69; (2)#H bond acceptors: 3; (3)#Freely Rotating Bonds: 1; (4)Polar Surface Area: 45.91 Å2; (5)Index of Refraction: 1.627; (6)Molar Refractivity: 53.04 cm3; (7)Molar Volume: 149.5 cm3; (8)Polarizability: 21.02×10-24 cm3; (9)Surface Tension: 57.6 dyne/cm; (10)Density: 1.23 g/cm3; (11)Flash Point: 172.9 °C; (12)Enthalpy of Vaporization: 60.82 kJ/mol; (13)Boiling Point: 362.2 °C at 760 mmHg; (14)Vapour Pressure: 1.96E-05 mmHg at 25 °C.

When you are using this chemical, please be cautious about it as the following:
It is harmful if swallowed. Besides, this chemical has risk of serious damage to eyes. When you are using it, wear eye/face protection. In case of 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#Cc1nc2ccc(OC)cc2cc1
(2)InChI: InChI=1/C11H8N2O/c1-14-10-4-5-11-8(6-10)2-3-9(7-12)13-11/h2-6H,1H3
(3)InChIKey: MOBUAKGGKVGTIE-UHFFFAOYAM
(4)Std. InChI: InChI=1S/C11H8N2O/c1-14-10-4-5-11-8(6-10)2-3-9(7-12)13-11/h2-6H,1H3
(5)Std. InChIKey: MOBUAKGGKVGTIE-UHFFFAOYSA-N