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Substance Name: 1,3-Difluoro-5-nitrobenzene
RN: 2265-94-3
InChIKey: AUQBBDWDLJSKMI-UHFFFAOYSA-N

Molecular Formula

  • C6-H3-F2-N-O2

Molecular Weight

  • 159.091
 
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Names and Synonyms

Synonym

  • EINECS 218-867-0

Systematic Name

  • 1,3-Difluoro-5-nitrobenzene

Registry Numbers

CAS Registry Number

  • 2265-94-3

System Generated Number

  • 0002265943

Structure Descriptors

InChI

1S/C6H3F2NO2/c7-4-1-5(8)3-6(2-4)9(10)11/h1-3H

InChIKey

AUQBBDWDLJSKMI-UHFFFAOYSA-N

Smiles

c1c(F)cc(F)cc1[N+]([O-])=O

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 17 deg C   EXP
Boiling Point 176.5 deg C   EXP
log P (octanol-water) 2.03 (none)   EXP
Water Solubility 520 mg/L 25 EST
Vapor Pressure 0.350 mm Hg 25 EST
Henry's Law Constant 2.90E-05 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 2.67E-13 cm3/molecule-sec 25 EST

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