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Substance Name: Coumaran
RN: 496-16-2
UNII: 99E861415L
InChIKey: HBEDSQVIWPRPAY-UHFFFAOYSA-N

Molecular Formula

  • C8-H8-O

Molecular Weight

  • 120.15
 
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Names and Synonyms

Name of Substance

  • Coumaran

Synonyms

  • Coumaran
  • EINECS 207-817-3
  • UNII-99E861415L

Systematic Names

  • 2,3-Dihydrobenzofuran
  • Benzofuran, 2,3-dihydro-

Registry Numbers

CAS Registry Number

  • 496-16-2

FDA UNII

  • 99E861415L

System Generated Number

  • 0000496162

Structure Descriptors

InChI

1S/C8H8O/c1-2-4-8-7(3-1)5-6-9-8/h1-4H,5-6H2

InChIKey

HBEDSQVIWPRPAY-UHFFFAOYSA-N

Smiles

c12c(OCC1)cccc2

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -2.15E+01 deg C   EXP
Boiling Point 188.5 deg C   EXP
log P (octanol-water) 2.14 (none)   EXP
Water Solubility 1490 mg/L 25 EST
Vapor Pressure 0.748 mm Hg 25 EST
Henry's Law Constant 1.55E-04 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 3.66E-11 cm3/molecule-sec 25 EXP

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