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CAS No.: | 171850-29-6 |
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Name: | 5,7-DICHLOROQUINOLIN-4-OL |
Article Data: | 7 |
Molecular Structure: | |
Formula: | C9H5Cl2NO |
Molecular Weight: | 214.051 |
Synonyms: | 5,7-Dichloro-4-hydroxyquinoline; |
EINECS: | 427-420-0 |
Density: | 1.466 g/cm3 |
Boiling Point: | 340.2 °C at 760 mmHg |
Flash Point: | 159.5 °C |
Risk Codes: | Irritant:; "> Irritant:; |
PSA: | 33.12000 |
LogP: | 3.24720 |
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The 5,7-Dichloro-4-hydroxyquinoline is an organic compound with the formula C9H5Cl2NO. The systematic name of this chemical is 5,7-dichloroquinolin-4(1H)-one. With the CAS registry number 171850-29-6, it is also named as 4(1H)-quinolinone, 5,7-dichloro-. The product's category is Quinoline.
Physical properties about 5,7-Dichloro-4-hydroxyquinoline are: (1)ACD/LogP: 4.57; (2)ACD/LogD (pH 5.5): 4.57; (3)ACD/LogD (pH 7.4): 4.57; (4)ACD/BCF (pH 5.5): 1751.44; (5)ACD/BCF (pH 7.4): 1751.46; (6)ACD/KOC (pH 5.5): 7298.24; (7)ACD/KOC (pH 7.4): 7298.31; (8)#H bond acceptors: 2; (9)#H bond donors: 1; (10)Polar Surface Area: 20.31 Å2; (11)Index of Refraction: 1.62; (12)Molar Refractivity: 51.29 cm3; (13)Molar Volume: 145.9 cm3; (14)Polarizability: 20.33×10-24cm3; (15)Surface Tension: 49.8 dyne/cm; (16)Density: 1.466 g/cm3; (17)Flash Point: 159.5 °C; (18)Enthalpy of Vaporization: 58.37 kJ/mol; (19)Boiling Point: 340.2 °C at 760 mmHg; (20)Vapour Pressure: 8.74E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Clc1cc2c(c(Cl)c1)C(=O)\C=C/N2
(2)InChI: InChI=1/C9H5Cl2NO/c10-5-3-6(11)9-7(4-5)12-2-1-8(9)13/h1-4H,(H,12,13)
(3)InChIKey: GESHSYASHHORJB-UHFFFAOYAT
(4)Std. InChI: InChI=1S/C9H5Cl2NO/c10-5-3-6(11)9-7(4-5)12-2-1-8(9)13/h1-4H,(H,12,13)
(5)Std. InChIKey: GESHSYASHHORJB-UHFFFAOYSA-N