4-chloroquinoline-6-carbonitrile supplier

Name
4-CHLORO-6-CYANOQUINOLINE
EINECS
CAS No. 219763-83-4
Article Data6
CAS DataBase
Density 1.363 g/cm³
Solubility
Melting Point
Formula C₁₀H₅ClN₂
Boiling Point 340.299 °C at 760 mmHg
Molecular Weight 188.616
Flash Point 159.608 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4-Chloro-6-cyanoquinoline;4-Chloroquinoline-6-carbonitrile;
PSA 36.68000
LogP 2.75988

4-chloroquinoline-6-carbonitrile Specification

The 4-chloroquinoline-6-carbonitrile, with the CAS registry number 219763-83-4, is also known as 4-Chloro-6-cyanoquinoline. This chemical's molecular formula is C₁₀H₅ClN₂ and molecular weight is 188.61. What's more, its systematic name is 4-Chloroquinoline-6-carbonitrile.

Physical properties of 4-chloroquinoline-6-carbonitrile are: (1)ACD/LogP: 3.52; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2; (4)ACD/LogD (pH 7.4): 2; (5)ACD/BCF (pH 5.5): 36; (6)ACD/BCF (pH 7.4): 36; (7)ACD/KOC (pH 5.5): 455; (8)ACD/KOC (pH 7.4): 456; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 36.68 Å²; (13)Index of Refraction: 1.667; (14)Molar Refractivity: 51.503 cm³; (15)Molar Volume: 138.405 cm³; (16)Polarizability: 20.418×10^-24cm³; (17)Surface Tension: 63.439 dyne/cm; (18)Density: 1.363 g/cm³; (19)Flash Point: 159.608 °C; (20)Enthalpy of Vaporization: 58.384 kJ/mol; (21)Boiling Point: 340.299 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: N#Cc1ccc2nccc(Cl)c2c1
(2)InChI: InChI=1S/C10H5ClN2/c11-9-3-4-13-10-2-1-7(6-12)5-8(9)10/h1-5H
(3)InChIKey: FLRGXIDFVYOCLP-UHFFFAOYSA-N

Product Name

4-CHLORO-6-CYANOQUINOLINE

4-chloroquinoline-6-carbonitrile Specification

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