8-Bromo-4-chloroquinoline supplier

Name
8-BROMO-4-CHLOROQUINOLINE
EINECS -0
CAS No. 65340-71-8
Article Data7
CAS DataBase
Density 1.673 g/cm³
Solubility
Melting Point 147-148 °C(Solv: ethanol (64-17-5); water (7732-18-5))
Formula C₉H₅BrClN
Boiling Point 314.6 °C at 760 mmHg
Molecular Weight 242.502
Flash Point 144.1 °C
Transport Information
Appearance
Safety 26-39-45
Risk Codes 25-41
Molecular Structure
Hazard Symbols T
Synonyms 8-Bromo-4-chloroquinoline;
PSA 12.89000
LogP 3.65070

8-Bromo-4-chloroquinoline Specification

The 8-Bromo-4-chloroquinoline, with the cas registry number of 65340-71-8, is also called quinoline, 8-bromo-4-chloro-. The molecular formula of the chemical is C₉H₅BrClN.

The characteristics of this chemical are as followings: (1)ACD/LogP: 3.55; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.55; (4)ACD/LogD (pH 7.4): 3.55; (5)ACD/BCF (pH 5.5): 294.13; (6)ACD/BCF (pH 7.4): 294.14; (7)ACD/KOC (pH 5.5): 2035.08; (8)ACD/KOC (pH 7.4): 2035.13; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 12.89 Å²; (13)Index of Refraction: 1.68; (14)Molar Refractivity: 54.77 cm³; (15)Molar Volume: 144.9 cm³; (16)Polarizability: 21.71×10^-24cm³; (17)Surface Tension: 53.3 dyne/cm; (18)Density: 1.673 g/cm³; (19)Flash Point: 144.1 °C; (20)Enthalpy of Vaporization: 53.36 kJ/mol; (21)Boiling Point: 314.6 °C at 760 mmHg; (22)Vapour Pressure: 0.000853 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: Brc1cccc2c(Cl)ccnc12
(2)InChI: InChI=1/C9H5BrClN/c10-7-3-1-2-6-8(11)4-5-12-9(6)7/h1-5H
(3)InChIKey: DAHYJSFUKJLEEJ-UHFFFAOYAO

Product Name

8-BROMO-4-CHLOROQUINOLINE

8-Bromo-4-chloroquinoline Specification

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