5-Bromo-8-nitroquinoline supplier

Name
5-Bromo-8-nitroquinoline
EINECS
CAS No. 176967-80-9
Article Data6
CAS DataBase
Density 1.747 g/cm³
Solubility
Melting Point
Formula C₉H₅BrN₂O₂
Boiling Point 370.5 °C at 760 mmHg
Molecular Weight 253.055
Flash Point 177.9 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 5-Bromo-8-nitro-quinoline;quinoline, 5-bromo-8-nitro-
PSA 58.71000
LogP 3.42870

5-Bromo-8-nitroquinoline Specification

The 5-Bromo-8-nitroquinoline is an organic compound with the formula C₉H₅BrN₂O₂. The systematic name of this chemical is 5-bromo-8-nitroquinoline. With the CAS registry number 176967-80-9, it is also named as quinoline, 5-bromo-8-nitro-.

Physical properties about 5-Bromo-8-nitroquinoline are: (1)ACD/LogP: 2.07; (2)ACD/LogD (pH 5.5): 2.07; (3)ACD/LogD (pH 7.4): 2.07; (4)ACD/BCF (pH 5.5): 22.06; (5)ACD/BCF (pH 7.4): 22.06; (6)ACD/KOC (pH 5.5): 318.67; (7)ACD/KOC (pH 7.4): 318.68; (8)#H bond acceptors: 4; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 58.71 Å²; (11)Index of Refraction: 1.707; (12)Molar Refractivity: 56.42 cm³; (13)Molar Volume: 144.7 cm³; (14)Polarizability: 22.36×10^-24cm³; (15)Surface Tension: 65 dyne/cm; (16)Density: 1.747 g/cm³; (17)Flash Point: 177.9 °C; (18)Enthalpy of Vaporization: 59.31 kJ/mol; (19)Boiling Point: 370.5 °C at 760 mmHg; (20)Vapour Pressure: 2.35E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: [O-][N+](=O)c1ccc(Br)c2cccnc12
(2)InChI: InChI=1/C9H5BrN2O2/c10-7-3-4-8(12(13)14)9-6(7)2-1-5-11-9/h1-5H
(3)InChIKey: FELNBLNDYLAJLB-UHFFFAOYAY
(4)Std. InChI: InChI=1S/C9H5BrN2O2/c10-7-3-4-8(12(13)14)9-6(7)2-1-5-11-9/h1-5H
(5)Std. InChIKey: FELNBLNDYLAJLB-UHFFFAOYSA-N

Product Name

5-Bromo-8-nitroquinoline

5-Bromo-8-nitroquinoline Specification

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