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CAS No.: | 703-49-1 |
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Name: | 7,8-Dichloroquinoline |
Molecular Structure: | |
Formula: | C9H5Cl2N |
Molecular Weight: | 198.0 |
Synonyms: | Quinoline, 7,8-dichloro-; |
Density: | 1.407 g/cm3 |
Boiling Point: | 311.1 °C at 760 mmHg |
Flash Point: | 170.9 °C |
PSA: | 12.89000 |
LogP: | 3.54160 |
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The 7,8-Dichloroquinoline is an organic compound with the formula C9H5Cl2N. With the CAS registry number 703-49-1, the systematic name of this chemical is 7,8-dichloroquinoline.
Physical properties about 7,8-Dichloroquinoline are: (1)ACD/LogP: 2.96; (2)ACD/LogD (pH 5.5): 2.96; (3)ACD/LogD (pH 7.4): 2.96; (4)ACD/BCF (pH 5.5): 104.03; (5)ACD/BCF (pH 7.4): 104.03; (6)ACD/KOC (pH 5.5): 967.13; (7)ACD/KOC (pH 7.4): 967.15; (8)#H bond acceptors: 1; (9)Polar Surface Area: 12.89 Å2; (10)Index of Refraction: 1.66; (11)Molar Refractivity: 51.97 cm3; (12)Molar Volume: 140.6 cm3; (13)Polarizability: 20.6×10-24cm3; (14)Surface Tension: 51.5 dyne/cm; (15)Density: 1.407 g/cm3; (16)Flash Point: 170.9 °C; (17)Enthalpy of Vaporization: 52.99 kJ/mol; (18)Boiling Point: 311.1 °C at 760 mmHg; (19)Vapour Pressure: 0.00106 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Clc1c(Cl)ccc2cccnc12
(2)InChI: InChI=1/C9H5Cl2N/c10-7-4-3-6-2-1-5-12-9(6)8(7)11/h1-5H
(3)InChIKey: BQNIWGUGRICGFJ-UHFFFAOYAK
(4)Std. InChI: InChI=1S/C9H5Cl2N/c10-7-4-3-6-2-1-5-12-9(6)8(7)11/h1-5H
(5)Std. InChIKey: BQNIWGUGRICGFJ-UHFFFAOYSA-N