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Quinoline, 2,3-dibromo-

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Name

Quinoline, 2,3-dibromo-

EINECS
CAS No. 13721-00-1 Density 1.923g/cm3
PSA 12.89000 LogP 3.75980
Solubility Melting Point
Formula C9H5Br2N Boiling Point 332.5 °C at 760 mmHg
Molecular Weight 286.95 Flash Point 154.9 °C
Transport Information Appearance
Safety Risk Codes
Molecular Structure Molecular Structure of 13721-00-1 (Quinoline, 2,3-dibromo-) Hazard Symbols
Synonyms

2,3-Dibromoquinoline;

 

Quinoline, 2,3-dibromo- Specification

The Quinoline, 2,3-dibromo-, with CAS registry number 13721-00-1, has the systematic name of 2,3-dibromoquinoline. Its molecular weight is 286.95. And the chemical formula of this chemical is C9H5Br2N.

Physical properties of Quinoline, 2,3-dibromo-: (1)ACD/LogP: 3.67; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 1; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 0; (6)Polar Surface Area: 12.89 Å2; (7)Index of Refraction: 1.698; (8)Molar Refractivity: 57.56 cm3; (9)Molar Volume: 149.1 cm3; (10)Polarizability: 22.82×10-24cm3; (11)Surface Tension: 55 dyne/cm; (12)Density: 1.923 g/cm3; (13)Flash Point: 154.9 °C; (14)Enthalpy of Vaporization: 55.25 kJ/mol; (15)Boiling Point: 332.5 °C at 760 mmHg; (16)Vapour Pressure: 0.00028 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Brc1cc2ccccc2nc1Br
(2)InChI: InChI=1/C9H5Br2N/c10-7-5-6-3-1-2-4-8(6)12-9(7)11/h1-5H
(3)InChIKey: KWVPZTJLHQKCKD-UHFFFAOYAF
(4)Std. InChI: InChI=1S/C9H5Br2N/c10-7-5-6-3-1-2-4-8(6)12-9(7)11/h1-5H
(5)Std. InChIKey: KWVPZTJLHQKCKD-UHFFFAOYSA-N

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