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Substance Name: Quinoline, 6-bromo-
RN: 5332-25-2
InChIKey: IFIHYLCUKYCKRH-UHFFFAOYSA-N

Molecular Formula

  • C9-H6-Br-N

Molecular Weight

  • 208.057
 
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Names and Synonyms

Synonyms

  • 6-Bromoquinoline
  • EINECS 226-238-7
  • NSC 3996
  • Quinoline, 6-bromo-

Systematic Names

  • 6-Bromoquinoline
  • Quinoline, 6-bromo-

Registry Numbers

CAS Registry Number

  • 5332-25-2

System Generated Number

  • 0005332252

Structure Descriptors

InChI

1S/C9H6BrN/c10-8-3-4-9-7(6-8)2-1-5-11-9/h1-6H

InChIKey

IFIHYLCUKYCKRH-UHFFFAOYSA-N

Smiles

n1c2c(cc(cc2)Br)ccc1

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 24 deg C   EXP
Boiling Point 281 deg C   EXP
pKa Dissociation Constant 3.87 (none) 25 EXP
log P (octanol-water) 2.83 (none)   EXP
Water Solubility 152 mg/L 25 EST
Vapor Pressure 1.47E-03 mm Hg 25 EST
Henry's Law Constant 2.74E-07 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 9.06E-12 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.