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2-Chloro-3-hydroxyquinoline

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Name

2-Chloro-3-hydroxyquinoline

EINECS N/A
CAS No. 128676-94-8 Density 1.412 g/cm3
PSA 33.12000 LogP 2.59380
Solubility N/A Melting Point >210 °C
Formula C9H6ClNO Boiling Point 315.201 °C at 760 mmHg
Molecular Weight 179.60 Flash Point 144.428 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 128676-94-8 (2-CHLOROQUINOLIN-3-OL) Hazard Symbols N/A
Synonyms

2-Chloro-3-hydroxyquinoline;

Article Data 6

2-Chloro-3-hydroxyquinoline Specification

The 2-Chloro-3-hydroxyquinoline is an organic compound with the formula C9H6ClNO. The systematic name of this chemical is 2-chloroquinolin-3-ol. With the CAS registry number 128676-94-8, it is also named as Monochlorohydroxyquinoline.

Physical properties about 2-Chloro-3-hydroxyquinoline are: (1)ACD/LogP: 2.68; (2)ACD/LogD (pH 5.5): 3; (3)ACD/LogD (pH 7.4): 2; (4)ACD/BCF (pH 5.5): 58; (5)ACD/BCF (pH 7.4): 8; (6)ACD/KOC (pH 5.5): 620; (7)ACD/KOC (pH 7.4): 86; (8)#H bond acceptors: 2; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 33.12 Å2; (12)Index of Refraction: 1.697; (13)Molar Refractivity: 48.963 cm3; (14)Molar Volume: 127.154 cm3; (15)Polarizability: 19.411×10-24cm3; (16)Surface Tension: 61.539 dyne/cm; (17)Density: 1.412 g/cm3; (18)Flash Point: 144.428 °C; (19)Enthalpy of Vaporization: 57.859 kJ/mol; (20)Boiling Point: 315.201 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: Oc1cc2ccccc2nc1Cl
(2)InChI: InChI=1/C9H6ClNO/c10-9-8(12)5-6-3-1-2-4-7(6)11-9/h1-5,12H
(3)InChIKey: YXEMPRTUAQVUOI-UHFFFAOYAU
(4)Std. InChI: InChI=1S/C9H6ClNO/c10-9-8(12)5-6-3-1-2-4-7(6)11-9/h1-5,12H
(5)Std. InChIKey: YXEMPRTUAQVUOI-UHFFFAOYSA-N

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