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4-Chloro-7-hydroxyquinoline

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Name

4-Chloro-7-hydroxyquinoline

EINECS 200-589-5
CAS No. 181950-57-2 Density 1.412 g/cm3
PSA 33.12000 LogP 2.59380
Solubility N/A Melting Point N/A
Formula C9H6ClNO Boiling Point 329.3 °C at 760 mmHg
Molecular Weight 179.606 Flash Point 152.955 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 181950-57-2 (4-Chloro-7-hydroxyquinoline) Hazard Symbols N/A
Synonyms

7-Quinolinol, 4-chloro-;

Article Data 2

4-Chloro-7-hydroxyquinoline Specification

The 4-Chloro-7-hydroxyquinoline with the CAS number 181950-57-2 is also called 7-Quinolinol, 4-chloro-. The systematic name is 4-chloroquinolin-7-ol. Its molecular formula is C9H6ClNO. This chemical is a kind of organics. It should be stored in dry and cool environment.

The properties of the 4-Chloro-7-hydroxyquinoline are: (1)ACD/LogP: 3.56; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4; (4)ACD/LogD (pH 7.4): 4; (5)ACD/BCF (pH 5.5): 282; (6)ACD/BCF (pH 7.4): 264; (7)ACD/KOC (pH 5.5): 1939; (8)ACD/KOC (pH 7.4): 1817; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 33.12 Å2; (13)Index of Refraction: 1.697; (14)Molar Refractivity: 48.963 cm3; (15)Molar Volume: 127.154 cm3; (16)Polarizability: 19.411×10-24cm3; (17)Surface Tension: 61.539 dyne/cm; (18)Enthalpy of Vaporization: 59.447 kJ/mol; (19)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: c1cc2c(ccnc2cc1O)Cl
(2)InChI: InChI=1/C9H6ClNO/c10-8-3-4-11-9-5-6(12)1-2-7(8)9/h1-5,12H
(3)InChIKey: SQWLNFPPFMFTIC-UHFFFAOYAZ

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