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2-Quinolinecarboxaldehyde, 8-chloro-

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Name

2-Quinolinecarboxaldehyde, 8-chloro-

EINECS N/A
CAS No. 59394-28-4 Density 1.364 g/cm3
PSA 29.96000 LogP 2.70070
Solubility N/A Melting Point 129-131 °C
Formula C10H6ClNO Boiling Point 349.3 °C at 760 mmHg
Molecular Weight 191.617 Flash Point 165 °C
Transport Information N/A Appearance N/A
Safety 26 Risk Codes 22-36
Molecular Structure Molecular Structure of 59394-28-4 (8-CHLORO-QUINOLINE-2-CARBALDEHYDE) Hazard Symbols IrritantXi
Synonyms

8-Chloroquinoline-2-carbaldehyde;

Article Data 9

2-Quinolinecarboxaldehyde, 8-chloro- Specification

The 2-Quinolinecarboxaldehyde, 8-chloro- is an organic compound with the formula C10H6ClNO. The systematic name of this chemical is 8-Chloroquinoline-2-carbaldehyde. With the CAS registry number 59394-28-4, it is also named as 8-Chloro-quinoline-2-carbaldehyde. Besides, its molecular weight is 191.61.

The physical properties of 2-Quinolinecarboxaldehyde, 8-chloro- are: (1)ACD/LogP: 2.39; (2)ACD/LogD (pH 5.5): 2.39; (3)ACD/LogD (pH 7.4): 2.39; (4)ACD/BCF (pH 5.5): 38.32; (5)ACD/BCF (pH 7.4): 38.32; (6)ACD/KOC (pH 5.5): 473.16; (7)ACD/KOC (pH 7.4): 473.17; (8)#H bond acceptors: 2; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 29.96 Å2; (11)Index of Refraction: 1.692; (12)Molar Refractivity: 53.83 cm3; (13)Molar Volume: 140.3 cm3; (14)Polarizability: 21.34×10-24 cm3; (15)Surface Tension: 57.2 dyne/cm; (16)Density: 1.364 g/cm3; (17)Flash Point: 165 °C; (18)Enthalpy of Vaporization: 59.37 kJ/mol; (19)Boiling Point: 349.3 °C at 760 mmHg; (20)Vapour Pressure: 4.76E-05 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc1cccc2ccc(nc12)C=O
(2)InChI: InChI=1/C10H6ClNO/c11-9-3-1-2-7-4-5-8(6-13)12-10(7)9/h1-6H
(3)InChIKey: RQWZBYLWUUPXJE-UHFFFAOYAG
(4)Std. InChI: InChI=1S/C10H6ClNO/c11-9-3-1-2-7-4-5-8(6-13)12-10(7)9/h1-6H
(5)Std. InChIKey: RQWZBYLWUUPXJE-UHFFFAOYSA-N

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