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859962-48-4

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Basic Information
CAS No.: 859962-48-4
Name: 8-Bromoacetylquinoline hydrobromide
Molecular Structure:
Molecular Structure of 859962-48-4 (8-Bromoacetylquinoline hydrobromide)
Formula: C11H8 Br N O . Br H
Molecular Weight: 331.007
Synonyms: Ketone,bromomethyl 8-quinolyl, -HBr (4CI)
Boiling Point: 392.2oC at 760 mmHg
Flash Point: 191oC
Hazard Symbols: IrritantXi
PSA: 29.96000
LogP: 3.77050
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Chemistry

Molecular Structure of 8-Bromoacetylquinoline hydrobromide (CAS NO.859962-48-4):

Systematic Name: 2-Bromo-1-(8-quinolyl)ethanone hydrobromide 
Molecular Formula: C11H8BrNO.HBr
Molecular Weight: 331.00 
H bond acceptors: 2
H bond donors: 0
Freely Rotating Bonds: 2 
Nominal Mass: 329
Average Mass: 331.0033 
Monoisotopic Mass: 328.905074
Flash Point: 191 °C
Enthalpy of Vaporization: 66.2 kJ/mol
Boiling Point: 392.2 °C at 760 mmHg
Vapour Pressure: 1.21E-06 mmHg at 25 °C
Product Categories: Quinolines; quinoline
SMILES: c1cc2cccnc2c(c1)C(=O)CBr.Br
InChI: InChI=1/C11H8BrNO.BrH/c12-7-10(14)9-5-1-3-8-4-2-6-13-11(8)9;/h1-6H,7H2;1H
InChIKey: ZUTPGJMJHOXJDW-UHFFFAOYAI

Safety Profile

Safety Information of 8-Bromoacetylquinoline hydrobromide (CAS NO.859962-48-4):
Hazard Codes: IrritantXi

Specification

 8-Bromoacetylquinoline hydrobromide (CAS NO.859962-48-4), its Synonyms are Ethanone,2-bromo-1-(8-quinolinyl)-, hydrobromide (1:1) ; Ketone,bromomethyl 8-quinolyl, -HBr (4CI) ; 2-Bromo-1-(quinolin-8-yl)ethanone hydrobromide (1:1) ; 2-Bromo-1-quinolin-8-ylethan-1-one hydrobromide .