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Substance Name: 1,4-Naphthalenedione, 2-bromo- (9CI)
RN: 2065-37-4
InChIKey: KJOHPBJYGGFYBJ-UHFFFAOYSA-N

Molecular Formula

  • C10-H5-Br-O2

Molecular Weight

  • 237.0515
 
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Names and Synonyms

Synonyms

  • 2-Bromo-1,4-naphthoquinone
  • 3-Bromo-1,4-naphthoquinone
  • NSC 401097

Systematic Names

  • 1,4-Naphthalenedione, 2-bromo- (9CI)
  • 1,4-Naphthoquinone, 2-bromo- (8CI)

Registry Numbers

CAS Registry Number

  • 2065-37-4

System Generated Number

  • 0002065374

Structure Descriptors

InChI

1S/C10H5BrO2/c11-8-5-9(12)6-3-1-2-4-7(6)10(8)13/h1-5H

InChIKey

KJOHPBJYGGFYBJ-UHFFFAOYSA-N

Smiles

c1ccc2c(c1)C(=O)C=C(C2=O)Br

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 2.44 (none)   EXP
Water Solubility 230 mg/L 25 EST
Vapor Pressure 2.58E-05 mm Hg 25 EST
Henry's Law Constant 3.92E-10 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 3.52E-12 cm3/molecule-sec 25 EST

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