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676262-10-5

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Basic Information
CAS No.: 676262-10-5
Name: 4-Methoxy-6-chloroquinoline
Article Data: 2
Molecular Structure:
Molecular Structure of 676262-10-5 (4-Methoxy-6-chloroquinoline)
Formula: C10H8ClNO
Molecular Weight: 193.633
Synonyms: 4-METHOXY-6-CHLOROQUINOLINE;6-Chloro-4-methoxyquinoline
Density: 1.268g/cm3
Boiling Point: 282.171 °C at 760 mmHg
Flash Point: 124.453 °C
PSA: 22.12000
LogP: 2.89680
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Specification

The 4-Methoxy-6-chloroquinoline, with CAS registry number 676262-10-5, has the systematic name of 6-chloro-4-methoxyquinoline. Its molecular weight is 193.63. And the chemical formula of this chemical is C10H8ClNO.

Physical properties of 4-Methoxy-6-chloroquinoline: (1)ACD/LogP: 3.32; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3; (4)ACD/LogD (pH 7.4): 3; (5)ACD/BCF (pH 5.5): 52; (6)ACD/BCF (pH 7.4): 110; (7)ACD/KOC (pH 5.5): 474; (8)ACD/KOC (pH 7.4): 1001; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 22.12 Å2; (13)Index of Refraction: 1.622; (14)Molar Refractivity: 53.76 cm3; (15)Molar Volume: 152.726 cm3; (16)Polarizability: 21.312×10-24cm3; (17)Surface Tension: 46.023 dyne/cm; (18)Density: 1.268 g/cm3; (19)Flash Point: 124.453 °C; (20)Enthalpy of Vaporization: 50.009 kJ/mol; (21)Boiling Point: 282.171 °C at 760 mmHg; (22)Vapour Pressure: 0.006 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc1ccc2nccc(OC)c2c1
(2)InChI: InChI=1/C10H8ClNO/c1-13-10-4-5-12-9-3-2-7(11)6-8(9)10/h2-6H,1H3
(3)InChIKey: UMCWMAIKLWFHTO-UHFFFAOYAR
(4)Std. InChI: InChI=1S/C10H8ClNO/c1-13-10-4-5-12-9-3-2-7(11)6-8(9)10/h2-6H,1H3
(5)Std. InChIKey: UMCWMAIKLWFHTO-UHFFFAOYSA-N